AX07515
1537859-24-7 | Ethanone, 1-[4-[3-fluoro-4-[[(3S,6R)-tetrahydro-3-methyl-1,1-dioxido-6-phenyl-2H-1,2-thiazin-2-yl]methyl]phenyl]-1-piperazinyl]-
Manufacturer: A2B Chem
CAS Number: 1537859-24-7
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Catalog Number
AX07515
Chemical Name
Ethanone, 1-[4-[3-fluoro-4-[[(3S,6R)-tetrahydro-3-methyl-1,1-dioxido-6-phenyl-2H-1,2-thiazin-2-yl]methyl]phenyl]-1-piperazinyl]-
Cas Number
1537859-24-7
Molecular Formula
C24H30FN3O3S
Molecular Weight
459.5767
Mdl Number
MFCD30533414
Smiles
C[C@H]1CC[C@@H](S(=O)(=O)N1Cc1ccc(cc1F)N1CCN(CC1)C(=O)C)c1ccccc1
Complexity
744
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Heavy Atom Count
32
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
4
Xlogp3
3
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Catalog Number: AX07515
Chemical Name: Ethanone, 1-[4-[3-fluoro-4-[[(3S,6R)-tetrahydro-3-methyl-1,1-dioxido-6-phenyl-2H-1,2-thiazin-2-yl]methyl]phenyl]-1-piperazinyl]-
Cas Number: 1537859-24-7
Molecular Formula: C24H30FN3O3S
Molecular Weight: 459.5767
Mdl Number: MFCD30533414
Smiles: C[C@H]1CC[C@@H](S(=O)(=O)N1Cc1ccc(cc1F)N1CCN(CC1)C(=O)C)c1ccccc1
Complexity: 744
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 2
Heavy Atom Count: 32
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 4
Xlogp3: 3
Catalog Number:
AX07515
Chemical Name:
Ethanone, 1-[4-[3-fluoro-4-[[(3S,6R)-tetrahydro-3-methyl-1,1-dioxido-6-phenyl-2H-1,2-thiazin-2-yl]methyl]phenyl]-1-piperazinyl]-
Cas Number:
1537859-24-7
Molecular Formula:
C24H30FN3O3S
Molecular Weight:
459.5767
Mdl Number:
MFCD30533414
Smiles:
C[C@H]1CC[C@@H](S(=O)(=O)N1Cc1ccc(cc1F)N1CCN(CC1)C(=O)C)c1ccccc1
Complexity:
744
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Xlogp3:
3
Catalog Number: AX07517
Chemical Name: (5R,6S)-allyl 6-((R)-1-((tert-butyldimethylsilyl)oxy)ethyl)-7-oxo-3-(propylsulfinyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Cas Number: 1392406-55-1
Molecular Formula: C20H33NO5S2Si
Molecular Weight: 459.6952
Mdl Number: __
Smiles: CCCS(=O)C1=C(C(=O)OCC=C)N2[C@H](S1)[C@H](C2=O)[C@H](O[Si](C(C)(C)C)(C)C)C
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AX07517
Chemical Name:
(5R,6S)-allyl 6-((R)-1-((tert-butyldimethylsilyl)oxy)ethyl)-7-oxo-3-(propylsulfinyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Cas Number:
1392406-55-1
Molecular Formula:
C20H33NO5S2Si
Molecular Weight:
459.6952
Mdl Number:
__
Smiles:
CCCS(=O)C1=C(C(=O)OCC=C)N2[C@H](S1)[C@H](C2=O)[C@H](O[Si](C(C)(C)C)(C)C)C
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AX07527
Chemical Name: (S)-Ethyl 2-acetamido-3-(4-(((2,2,2-trichloroethoxy)sulfonyl)methyl)phenyl)propanoate
Cas Number: 1146758-12-4
Molecular Formula: C16H20Cl3NO6S
Molecular Weight: 460.7571
Mdl Number: MFCD30185077
Smiles: CCOC(=O)[C@H](Cc1ccc(cc1)CS(=O)(=O)OCC(Cl)(Cl)Cl)NC(=O)C
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AX07527
Chemical Name:
(S)-Ethyl 2-acetamido-3-(4-(((2,2,2-trichloroethoxy)sulfonyl)methyl)phenyl)propanoate
Cas Number:
1146758-12-4
Molecular Formula:
C16H20Cl3NO6S
Molecular Weight:
460.7571
Mdl Number:
MFCD30185077
Smiles:
CCOC(=O)[C@H](Cc1ccc(cc1)CS(=O)(=O)OCC(Cl)(Cl)Cl)NC(=O)C
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AX07529
Chemical Name: 1-(3-methoxy-5-nitro-4-propoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione
Cas Number: 154543-77-8
Molecular Formula: C23H27NO9
Molecular Weight: 461.4618
Mdl Number: __
Smiles: CCCOc1c(OC)cc(cc1[N+](=O)[O-])C(=O)CCC(=O)c1cc(OC)c(c(c1)OC)OC
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AX07529
Chemical Name:
1-(3-methoxy-5-nitro-4-propoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione
Cas Number:
154543-77-8
Molecular Formula:
C23H27NO9
Molecular Weight:
461.4618
Mdl Number:
__
Smiles:
CCCOc1c(OC)cc(cc1[N+](=O)[O-])C(=O)CCC(=O)c1cc(OC)c(c(c1)OC)OC
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__