AB39503
3034-31-9 | N-Phenylisonicotinamide
Manufacturer: A2B Chem
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CatalogNumber
AB39503
ChemicalName
N-Phenylisonicotinamide
CasNumber
3034-31-9
MolecularFormula
C12H10N2O
MolecularWeight
198.2206
MdlNumber
MFCD00459246
Smiles
O=C(c1ccncc1)Nc1ccccc1
NscNumber
4266
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB39503
ChemicalName: N-Phenylisonicotinamide
CasNumber: 3034-31-9
MolecularFormula: C12H10N2O
MolecularWeight: 198.2206
MdlNumber: MFCD00459246
Smiles: O=C(c1ccncc1)Nc1ccccc1
NscNumber: 4266
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB39503
ChemicalName:
N-Phenylisonicotinamide
CasNumber:
3034-31-9
MolecularFormula:
C12H10N2O
MolecularWeight:
198.2206
MdlNumber:
MFCD00459246
Smiles:
O=C(c1ccncc1)Nc1ccccc1
NscNumber:
4266
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NNc1ccccc1[N+](=O)[O-]
NscNumber: __
Complexity: 145
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
NNc1ccccc1[N+](=O)[O-]
NscNumber:
__
Complexity:
145
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1cc(oc2c1cccc2)c1ccncc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1cc(oc2c1cccc2)c1ccncc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)[C@@H]1CC(=O)c2c(O1)cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)[C@@H]1CC(=O)c2c(O1)cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__