AE62437
1242069-41-5 | 1-Benzyl-1,2,3-benzotriazole-5-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE62437
ChemicalName
1-Benzyl-1,2,3-benzotriazole-5-carbonitrile
CasNumber
1242069-41-5
MolecularFormula
C14H10N4
MolecularWeight
234.256
MdlNumber
MFCD22549343
Smiles
N#Cc1ccc2c(c1)nnn2Cc1ccccc1
Complexity
328
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AE62437
ChemicalName: 1-Benzyl-1,2,3-benzotriazole-5-carbonitrile
CasNumber: 1242069-41-5
MolecularFormula: C14H10N4
MolecularWeight: 234.256
MdlNumber: MFCD22549343
Smiles: N#Cc1ccc2c(c1)nnn2Cc1ccccc1
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AE62437
ChemicalName:
1-Benzyl-1,2,3-benzotriazole-5-carbonitrile
CasNumber:
1242069-41-5
MolecularFormula:
C14H10N4
MolecularWeight:
234.256
MdlNumber:
MFCD22549343
Smiles:
N#Cc1ccc2c(c1)nnn2Cc1ccccc1
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.4
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Smiles: N#Cc1ccc2c(c1)nc(n2Cc1ccccc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
__
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Smiles:
N#Cc1ccc2c(c1)nc(n2Cc1ccccc1)C
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Fc1ccc(c(c1)OCc1ccccc1)c1ccc(cc1O)C(=O)O
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Smiles:
Fc1ccc(c(c1)OCc1ccccc1)c1ccc(cc1O)C(=O)O
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: COc1cc(ccc1F)c1ccc(cc1)C=O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1cc(ccc1F)c1ccc(cc1)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__