AF00727
1445322-49-5 | 3-(4-Cyanophenyl)-5-methoxybenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AF00727
ChemicalName
3-(4-Cyanophenyl)-5-methoxybenzonitrile
CasNumber
1445322-49-5
MolecularFormula
C15H10N2O
MolecularWeight
234.2527
MdlNumber
MFCD25121774
Smiles
N#Cc1ccc(cc1)c1cc(OC)cc(c1)C#N
Complexity
366
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3
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CatalogNumber: AF00727
ChemicalName: 3-(4-Cyanophenyl)-5-methoxybenzonitrile
CasNumber: 1445322-49-5
MolecularFormula: C15H10N2O
MolecularWeight: 234.2527
MdlNumber: MFCD25121774
Smiles: N#Cc1ccc(cc1)c1cc(OC)cc(c1)C#N
Complexity: 366
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AF00727
ChemicalName:
3-(4-Cyanophenyl)-5-methoxybenzonitrile
CasNumber:
1445322-49-5
MolecularFormula:
C15H10N2O
MolecularWeight:
234.2527
MdlNumber:
MFCD25121774
Smiles:
N#Cc1ccc(cc1)c1cc(OC)cc(c1)C#N
Complexity:
366
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1ccc(cc1)Oc1ccc(cc1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc(cc1)Oc1ccc(cc1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)c1ccc(cc1c1ccccc1)N
Complexity: 440
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSCC[C@@H](C(=O)OC)NC(=O)c1ccc(cc1c1ccccc1)N
Complexity:
440
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(c1ccc(cc1)N)(C)C
Complexity: 137
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(c1ccc(cc1)N)(C)C
Complexity:
137
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5