AI60383
901207-93-0 | 2-Amino-4-(2,4-dimethylphenyl)-3-thiophenecarbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI60383
ChemicalName
2-Amino-4-(2,4-dimethylphenyl)-3-thiophenecarbonitrile
CasNumber
901207-93-0
MolecularFormula
C13H12N2S
MolecularWeight
228.3128
MdlNumber
MFCD02854968
Smiles
N#Cc1c(N)scc1c1ccc(cc1C)C
Complexity
296
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.9
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CatalogNumber: AI60383
ChemicalName: 2-Amino-4-(2,4-dimethylphenyl)-3-thiophenecarbonitrile
CasNumber: 901207-93-0
MolecularFormula: C13H12N2S
MolecularWeight: 228.3128
MdlNumber: MFCD02854968
Smiles: N#Cc1c(N)scc1c1ccc(cc1C)C
Complexity: 296
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.9
CatalogNumber:
AI60383
ChemicalName:
2-Amino-4-(2,4-dimethylphenyl)-3-thiophenecarbonitrile
CasNumber:
901207-93-0
MolecularFormula:
C13H12N2S
MolecularWeight:
228.3128
MdlNumber:
MFCD02854968
Smiles:
N#Cc1c(N)scc1c1ccc(cc1C)C
Complexity:
296
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.9
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Smiles: [N-]=[N+]=NCCCC[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity: __
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Smiles:
[N-]=[N+]=NCCCC[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity:
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HeavyAtomCount:
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Smiles: Clc1ncc(c(n1)N1CCCCC1)c1ccccc1
Complexity: __
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Smiles:
Clc1ncc(c(n1)N1CCCCC1)c1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: ClCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__