AA80908
15923-40-7 | N-Benzoyl-4-perhydroazepinone
Manufacturer: A2B Chem
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CatalogNumber
AA80908
ChemicalName
N-Benzoyl-4-perhydroazepinone
CasNumber
15923-40-7
MolecularFormula
C13H15NO2
MolecularWeight
217.2637
MdlNumber
MFCD06412563
Smiles
O=C1CCCN(CC1)C(=O)c1ccccc1
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AA80908
ChemicalName: N-Benzoyl-4-perhydroazepinone
CasNumber: 15923-40-7
MolecularFormula: C13H15NO2
MolecularWeight: 217.2637
MdlNumber: MFCD06412563
Smiles: O=C1CCCN(CC1)C(=O)c1ccccc1
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AA80908
ChemicalName:
N-Benzoyl-4-perhydroazepinone
CasNumber:
15923-40-7
MolecularFormula:
C13H15NO2
MolecularWeight:
217.2637
MdlNumber:
MFCD06412563
Smiles:
O=C1CCCN(CC1)C(=O)c1ccccc1
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.2
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Smiles: CC(c1ccc(cc1)Br)F
Complexity: __
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(c1ccc(cc1)Br)F
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: C=Cc1cc(F)c(c(c1)F)F
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MolecularFormula:
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Smiles:
C=Cc1cc(F)c(c(c1)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: ClS(=O)(=O)Cc1cccnc1.ClS(=O)(=O)Cc1cccnc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
ClS(=O)(=O)Cc1cccnc1.ClS(=O)(=O)Cc1cccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__