AI58874
881002-28-4 | 4-Bromo-2-(piperidin-1-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI58874
ChemicalName
4-Bromo-2-(piperidin-1-yl)benzonitrile
CasNumber
881002-28-4
MolecularFormula
C12H13BrN2
MolecularWeight
265.149
MdlNumber
MFCD11037512
Smiles
N#Cc1ccc(cc1N1CCCCC1)Br
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
3.3
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CatalogNumber: AI58874
ChemicalName: 4-Bromo-2-(piperidin-1-yl)benzonitrile
CasNumber: 881002-28-4
MolecularFormula: C12H13BrN2
MolecularWeight: 265.149
MdlNumber: MFCD11037512
Smiles: N#Cc1ccc(cc1N1CCCCC1)Br
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 3.3
CatalogNumber:
AI58874
ChemicalName:
4-Bromo-2-(piperidin-1-yl)benzonitrile
CasNumber:
881002-28-4
MolecularFormula:
C12H13BrN2
MolecularWeight:
265.149
MdlNumber:
MFCD11037512
Smiles:
N#Cc1ccc(cc1N1CCCCC1)Br
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
3.3
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Smiles: CCOC(=O)CCC12CCC(CC1)(CC2)C(=O)O
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HydrogenBondAcceptorCount: __
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Smiles:
CCOC(=O)CCC12CCC(CC1)(CC2)C(=O)O
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Smiles: CCOc1c(ccc2c1cccc2)c1nnc(s1)N
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Smiles:
CCOc1c(ccc2c1cccc2)c1nnc(s1)N
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Smiles: Fc1ccc(cc1)c1cn2c(s1)nc(c2)c1ccc(cc1)Br
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Smiles:
Fc1ccc(cc1)c1cn2c(s1)nc(c2)c1ccc(cc1)Br
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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