AI37665
158692-52-5 | 2-Chloro-5-phenyl-1H-pyrrole-3-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI37665
ChemicalName
2-Chloro-5-phenyl-1H-pyrrole-3-carbonitrile
CasNumber
158692-52-5
MolecularFormula
C11H7ClN2
MolecularWeight
202.63968000000003
MdlNumber
MFCD24562363
Smiles
N#Cc1cc([nH]c1Cl)c1ccccc1
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.1
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CatalogNumber: AI37665
ChemicalName: 2-Chloro-5-phenyl-1H-pyrrole-3-carbonitrile
CasNumber: 158692-52-5
MolecularFormula: C11H7ClN2
MolecularWeight: 202.63968000000003
MdlNumber: MFCD24562363
Smiles: N#Cc1cc([nH]c1Cl)c1ccccc1
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AI37665
ChemicalName:
2-Chloro-5-phenyl-1H-pyrrole-3-carbonitrile
CasNumber:
158692-52-5
MolecularFormula:
C11H7ClN2
MolecularWeight:
202.63968000000003
MdlNumber:
MFCD24562363
Smiles:
N#Cc1cc([nH]c1Cl)c1ccccc1
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Fc1ccc(cc1)NCn1nnc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Fc1ccc(cc1)NCn1nnc2c1cccc2
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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__
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MolecularFormula: __
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Smiles: B(C1=CSC=C1CO)(O)O
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MolecularFormula:
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MolecularWeight:
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Smiles:
B(C1=CSC=C1CO)(O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Smiles: COC(=O)c1n[nH]c(c1N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1n[nH]c(c1N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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