AF00764
16777-78-9 | 4-(Phenylcarbamoyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF00764
ChemicalName
4-(Phenylcarbamoyl)benzoic acid
CasNumber
16777-78-9
MolecularFormula
C14H11NO3
MolecularWeight
241.242
MdlNumber
MFCD04329722
Smiles
O=C(c1ccc(cc1)C(=O)O)Nc1ccccc1
Complexity
302
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AF00764
ChemicalName: 4-(Phenylcarbamoyl)benzoic acid
CasNumber: 16777-78-9
MolecularFormula: C14H11NO3
MolecularWeight: 241.242
MdlNumber: MFCD04329722
Smiles: O=C(c1ccc(cc1)C(=O)O)Nc1ccccc1
Complexity: 302
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AF00764
ChemicalName:
4-(Phenylcarbamoyl)benzoic acid
CasNumber:
16777-78-9
MolecularFormula:
C14H11NO3
MolecularWeight:
241.242
MdlNumber:
MFCD04329722
Smiles:
O=C(c1ccc(cc1)C(=O)O)Nc1ccccc1
Complexity:
302
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1occc1c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1occc1c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)/C=C(/C(C)(C)C)C
Complexity: 173
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)/C=C(/C(C)(C)C)C
Complexity:
173
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AF00767
ChemicalName: Z-DL-Phg-NHCyh
CasNumber: 17922-88-2
MolecularFormula: C21H24N2O3
MolecularWeight: 352.4269
MdlNumber: MFCD22383744
Smiles: O=C(NC(c1ccccc1)C(=O)NC1CCCC1)OCc1ccccc1
Complexity: 464
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 4.3
CatalogNumber:
AF00767
ChemicalName:
Z-DL-Phg-NHCyh
CasNumber:
17922-88-2
MolecularFormula:
C21H24N2O3
MolecularWeight:
352.4269
MdlNumber:
MFCD22383744
Smiles:
O=C(NC(c1ccccc1)C(=O)NC1CCCC1)OCc1ccccc1
Complexity:
464
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
4.3