AI61876
925159-45-1 | Methyl 3-(benzylcarbamoyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AI61876
ChemicalName
Methyl 3-(benzylcarbamoyl)benzoate
CasNumber
925159-45-1
MolecularFormula
C16H15NO3
MolecularWeight
269.2952
MdlNumber
MFCD09234636
Smiles
COC(=O)c1cccc(c1)C(=O)NCc1ccccc1
Complexity
337
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.1
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CatalogNumber: AI61876
ChemicalName: Methyl 3-(benzylcarbamoyl)benzoate
CasNumber: 925159-45-1
MolecularFormula: C16H15NO3
MolecularWeight: 269.2952
MdlNumber: MFCD09234636
Smiles: COC(=O)c1cccc(c1)C(=O)NCc1ccccc1
Complexity: 337
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.1
CatalogNumber:
AI61876
ChemicalName:
Methyl 3-(benzylcarbamoyl)benzoate
CasNumber:
925159-45-1
MolecularFormula:
C16H15NO3
MolecularWeight:
269.2952
MdlNumber:
MFCD09234636
Smiles:
COC(=O)c1cccc(c1)C(=O)NCc1ccccc1
Complexity:
337
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.1
CatalogNumber: AI61877
ChemicalName: Methyl 3-(cyclohexylcarbamoyl)benzoate
CasNumber: 925159-60-0
MolecularFormula: C15H19NO3
MolecularWeight: 261.3163
MdlNumber: MFCD09234665
Smiles: COC(=O)c1cccc(c1)C(=O)NC1CCCCC1
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AI61877
ChemicalName:
Methyl 3-(cyclohexylcarbamoyl)benzoate
CasNumber:
925159-60-0
MolecularFormula:
C15H19NO3
MolecularWeight:
261.3163
MdlNumber:
MFCD09234665
Smiles:
COC(=O)c1cccc(c1)C(=O)NC1CCCCC1
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.9
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Smiles: O=C(c1cccc(c1)NC(=O)c1cccnc1)NCc1ccccc1
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O=C(c1cccc(c1)NC(=O)c1cccnc1)NCc1ccccc1
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Smiles: Fc1ccc(c(c1)B(O)O)NC(=O)C(C)(C)C
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Smiles:
Fc1ccc(c(c1)B(O)O)NC(=O)C(C)(C)C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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