AX08377
945551-93-9 | (1R, 2S)-N, N′-Bis[ (1S)-2-hydroxy-1-phenylmethylethyl ]-3, 3-dimethyl-1, 2-cyclopropanediamide
Manufacturer: A2B Chem
CAS Number: 945551-93-9
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Catalog Number
AX08377
Chemical Name
(1R, 2S)-N, N′-Bis[ (1S)-2-hydroxy-1-phenylmethylethyl ]-3, 3-dimethyl-1, 2-cyclopropanediamide
Cas Number
945551-93-9
Molecular Formula
C25H32N2O4
Molecular Weight
424.5326
Mdl Number
MFCD31803832
Smiles
OC[C@H](Cc1ccccc1)NC(=O)[C@@H]1[C@@H](C1(C)C)C(=O)N[C@@H](Cc1ccccc1)CO
Complexity
546
Covalently-Bonded Unit Count
1
Heavy Atom Count
31
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
4
Rotatable Bond Count
10
Undefined Atom Stereocenter Count
4
Xlogp3
2.4
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Catalog Number: AX08377
Chemical Name: (1R, 2S)-N, N′-Bis[ (1S)-2-hydroxy-1-phenylmethylethyl ]-3, 3-dimethyl-1, 2-cyclopropanediamide
Cas Number: 945551-93-9
Molecular Formula: C25H32N2O4
Molecular Weight: 424.5326
Mdl Number: MFCD31803832
Smiles: OC[C@H](Cc1ccccc1)NC(=O)[C@@H]1[C@@H](C1(C)C)C(=O)N[C@@H](Cc1ccccc1)CO
Complexity: 546
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 31
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 4
Rotatable Bond Count: 10
Undefined Atom Stereocenter Count: 4
Xlogp3: 2.4
Catalog Number:
AX08377
Chemical Name:
(1R, 2S)-N, N′-Bis[ (1S)-2-hydroxy-1-phenylmethylethyl ]-3, 3-dimethyl-1, 2-cyclopropanediamide
Cas Number:
945551-93-9
Molecular Formula:
C25H32N2O4
Molecular Weight:
424.5326
Mdl Number:
MFCD31803832
Smiles:
OC[C@H](Cc1ccccc1)NC(=O)[C@@H]1[C@@H](C1(C)C)C(=O)N[C@@H](Cc1ccccc1)CO
Complexity:
546
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Rotatable Bond Count:
10
Undefined Atom Stereocenter Count:
4
Xlogp3:
2.4
Catalog Number: AX08378
Chemical Name: 2-(7-Bromo-9,9-dihexyl-9H-fluoren-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Cas Number: 1048037-36-0
Molecular Formula: C31H44BBrO2
Molecular Weight: 539.3949
Mdl Number: MFCD30490664
Smiles: CCCCCCC1(CCCCCC)c2cc(Br)ccc2-c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AX08378
Chemical Name:
2-(7-Bromo-9,9-dihexyl-9H-fluoren-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Cas Number:
1048037-36-0
Molecular Formula:
C31H44BBrO2
Molecular Weight:
539.3949
Mdl Number:
MFCD30490664
Smiles:
CCCCCCC1(CCCCCC)c2cc(Br)ccc2-c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__
Catalog Number: AX08379
Chemical Name: Ethyl 4-amino-1-naphoate
Cas Number: 95092-84-5
Molecular Formula: C13H13NO2
Molecular Weight: 215.2478
Mdl Number: MFCD18414310
Smiles: CCOC(=O)c1ccc(c2c1cccc2)N
Complexity: 254
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 16
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 3
Undefined Atom Stereocenter Count: __
Xlogp3: 2.7
Catalog Number:
AX08379
Chemical Name:
Ethyl 4-amino-1-naphoate
Cas Number:
95092-84-5
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
Mdl Number:
MFCD18414310
Smiles:
CCOC(=O)c1ccc(c2c1cccc2)N
Complexity:
254
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
3
Undefined Atom Stereocenter Count:
__
Xlogp3:
2.7
Catalog Number: AX08380
Chemical Name: CArbamic acid, N-(5,6-dichloro-4-iodo-2-pyridinyl)-, 1,1-dimethylethyl ester
Cas Number: 1801693-97-9
Molecular Formula: C10H11Cl2IN2O2
Molecular Weight: 389.017
Mdl Number: MFCD31802596
Smiles: O=C(OC(C)(C)C)Nc1cc(I)c(c(n1)Cl)Cl
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AX08380
Chemical Name:
CArbamic acid, N-(5,6-dichloro-4-iodo-2-pyridinyl)-, 1,1-dimethylethyl ester
Cas Number:
1801693-97-9
Molecular Formula:
C10H11Cl2IN2O2
Molecular Weight:
389.017
Mdl Number:
MFCD31802596
Smiles:
O=C(OC(C)(C)C)Nc1cc(I)c(c(n1)Cl)Cl
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__