AI50335
42951-35-9 | 1-Butyl-2-methylindole
Manufacturer: A2B Chem
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CatalogNumber
AI50335
ChemicalName
1-Butyl-2-methylindole
CasNumber
42951-35-9
MolecularFormula
C13H17N
MolecularWeight
187.2808
MdlNumber
MFCD04972048
Smiles
CCCCn1c(C)cc2c1cccc2
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
14
RotatableBondCount
3
Xlogp3
4
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CatalogNumber: AI50335
ChemicalName: 1-Butyl-2-methylindole
CasNumber: 42951-35-9
MolecularFormula: C13H17N
MolecularWeight: 187.2808
MdlNumber: MFCD04972048
Smiles: CCCCn1c(C)cc2c1cccc2
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
RotatableBondCount: 3
Xlogp3: 4
CatalogNumber:
AI50335
ChemicalName:
1-Butyl-2-methylindole
CasNumber:
42951-35-9
MolecularFormula:
C13H17N
MolecularWeight:
187.2808
MdlNumber:
MFCD04972048
Smiles:
CCCCn1c(C)cc2c1cccc2
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
RotatableBondCount:
3
Xlogp3:
4
CatalogNumber: AI50336
ChemicalName: 1-Benzoyl-3-(2-hydroxy-5-methylphenyl)thiourea
CasNumber: 429642-03-5
MolecularFormula: C15H14N2O2S
MolecularWeight: 286.3489
MdlNumber: MFCD02631941
Smiles: S=C(Nc1cc(C)ccc1O)NC(=O)c1ccccc1
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AI50336
ChemicalName:
1-Benzoyl-3-(2-hydroxy-5-methylphenyl)thiourea
CasNumber:
429642-03-5
MolecularFormula:
C15H14N2O2S
MolecularWeight:
286.3489
MdlNumber:
MFCD02631941
Smiles:
S=C(Nc1cc(C)ccc1O)NC(=O)c1ccccc1
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
RotatableBondCount:
2
Xlogp3:
3.8
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Smiles: CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(n2C)CNc1ccc(cc1)C(=N)N)c1ccccn1.Cl
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Smiles:
CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(n2C)CNc1ccc(cc1)C(=N)N)c1ccccn1.Cl
Complexity:
__
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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