AB57886
952-92-1 | 1-Benzyl-1,4-dihydronicotinamide
Manufacturer: A2B Chem
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CatalogNumber
AB57886
ChemicalName
1-Benzyl-1,4-dihydronicotinamide
CasNumber
952-92-1
MolecularFormula
C13H14N2O
MolecularWeight
214.2631
MdlNumber
MFCD00059769
Smiles
NC(=O)C1=CN(C=CC1)Cc1ccccc1
NscNumber
26899
Complexity
314
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AB57886
ChemicalName: 1-Benzyl-1,4-dihydronicotinamide
CasNumber: 952-92-1
MolecularFormula: C13H14N2O
MolecularWeight: 214.2631
MdlNumber: MFCD00059769
Smiles: NC(=O)C1=CN(C=CC1)Cc1ccccc1
NscNumber: 26899
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AB57886
ChemicalName:
1-Benzyl-1,4-dihydronicotinamide
CasNumber:
952-92-1
MolecularFormula:
C13H14N2O
MolecularWeight:
214.2631
MdlNumber:
MFCD00059769
Smiles:
NC(=O)C1=CN(C=CC1)Cc1ccccc1
NscNumber:
26899
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: AB57887
ChemicalName: 1-Benzylpyrazole-4-boronic acid, pinacol ester
CasNumber: 761446-45-1
MolecularFormula: C16H21BN2O2
MolecularWeight: 284.16114000000005
MdlNumber: MFCD03789252
Smiles: CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccccc1
NscNumber: __
Complexity: 353
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB57887
ChemicalName:
1-Benzylpyrazole-4-boronic acid, pinacol ester
CasNumber:
761446-45-1
MolecularFormula:
C16H21BN2O2
MolecularWeight:
284.16114000000005
MdlNumber:
MFCD03789252
Smiles:
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccccc1
NscNumber:
__
Complexity:
353
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NN(c1ccccc1)Cc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NN(c1ccccc1)Cc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NN(c1ccccc1)Cc1ccccc1.Cl
NscNumber: __
Complexity: 169
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NN(c1ccccc1)Cc1ccccc1.Cl
NscNumber:
__
Complexity:
169
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__