AX06237
2102411-41-4 | (4-bromo-3-methylphenyl)(4-methoxy-3-nitrophenyl)methanone
Manufacturer: A2B Chem
CAS Number: 2102411-41-4
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Catalog Number
AX06237
Chemical Name
(4-bromo-3-methylphenyl)(4-methoxy-3-nitrophenyl)methanone
Cas Number
2102411-41-4
Molecular Formula
C15H12BrNO4
Molecular Weight
350.1641
Mdl Number
MFCD31555289
Smiles
COc1ccc(cc1[N+](=O)[O-])C(=O)c1ccc(c(c1)C)Br
Complexity
398
Covalently-Bonded Unit Count
1
Heavy Atom Count
21
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Xlogp3
4.1
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Catalog Number: AX06237
Chemical Name: (4-bromo-3-methylphenyl)(4-methoxy-3-nitrophenyl)methanone
Cas Number: 2102411-41-4
Molecular Formula: C15H12BrNO4
Molecular Weight: 350.1641
Mdl Number: MFCD31555289
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)c1ccc(c(c1)C)Br
Complexity: 398
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 21
Hydrogen Bond Acceptor Count: 4
Rotatable Bond Count: 3
Xlogp3: 4.1
Catalog Number:
AX06237
Chemical Name:
(4-bromo-3-methylphenyl)(4-methoxy-3-nitrophenyl)methanone
Cas Number:
2102411-41-4
Molecular Formula:
C15H12BrNO4
Molecular Weight:
350.1641
Mdl Number:
MFCD31555289
Smiles:
COc1ccc(cc1[N+](=O)[O-])C(=O)c1ccc(c(c1)C)Br
Complexity:
398
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Xlogp3:
4.1
Catalog Number: AX06242
Chemical Name: 2-(4-(methylsulfonyl)phenyl)-2-oxoethyl 2-(4-fluorophenyl)acetate
Cas Number: 157671-99-3
Molecular Formula: C17H15FO5S
Molecular Weight: 350.3614
Mdl Number: MFCD31803521
Smiles: O=C(Cc1ccc(cc1)F)OCC(=O)c1ccc(cc1)S(=O)(=O)C
Complexity: 538
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 24
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 7
Xlogp3: 2.5
Catalog Number:
AX06242
Chemical Name:
2-(4-(methylsulfonyl)phenyl)-2-oxoethyl 2-(4-fluorophenyl)acetate
Cas Number:
157671-99-3
Molecular Formula:
C17H15FO5S
Molecular Weight:
350.3614
Mdl Number:
MFCD31803521
Smiles:
O=C(Cc1ccc(cc1)F)OCC(=O)c1ccc(cc1)S(=O)(=O)C
Complexity:
538
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Xlogp3:
2.5
Catalog Number: AX06246
Chemical Name: (3S,4R)-Benzyl 3-((tert-butoxycarbonyl)amino)-4-hydroxypiperidine-1-carboxylate
Cas Number: 1549812-65-8
Molecular Formula: C18H26N2O5
Molecular Weight: 350.4094
Mdl Number: MFCD30534442
Smiles: O=C(OC(C)(C)C)N[C@H]1CN(CC[C@H]1O)C(=O)OCc1ccccc1
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AX06246
Chemical Name:
(3S,4R)-Benzyl 3-((tert-butoxycarbonyl)amino)-4-hydroxypiperidine-1-carboxylate
Cas Number:
1549812-65-8
Molecular Formula:
C18H26N2O5
Molecular Weight:
350.4094
Mdl Number:
MFCD30534442
Smiles:
O=C(OC(C)(C)C)N[C@H]1CN(CC[C@H]1O)C(=O)OCc1ccccc1
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AX06247
Chemical Name: 1-(tert-butoxycarbonyl)-4-((3-methoxyphenyl)amino)piperidine-4-carboxylic acid
Cas Number: 1159835-35-4
Molecular Formula: C18H26N2O5
Molecular Weight: 350.4094
Mdl Number: MFCD23115240
Smiles: COc1cccc(c1)NC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Complexity: 480
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 25
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 6
Xlogp3: 2.7
Catalog Number:
AX06247
Chemical Name:
1-(tert-butoxycarbonyl)-4-((3-methoxyphenyl)amino)piperidine-4-carboxylic acid
Cas Number:
1159835-35-4
Molecular Formula:
C18H26N2O5
Molecular Weight:
350.4094
Mdl Number:
MFCD23115240
Smiles:
COc1cccc(c1)NC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Complexity:
480
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Xlogp3:
2.7