AB61935
929000-87-3 | 2-Cyano-1-(4-methoxyphenyl)-2(1H)-pyridinone
Manufacturer: A2B Chem
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CatalogNumber
AB61935
ChemicalName
2-Cyano-1-(4-methoxyphenyl)-2(1H)-pyridinone
CasNumber
929000-87-3
MolecularFormula
C13H10N2O2
MolecularWeight
226.2307
MdlNumber
MFCD09258785
Smiles
COc1ccc(cc1)n1cccc(c1=O)C#N
Complexity
408
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AB61935
ChemicalName: 2-Cyano-1-(4-methoxyphenyl)-2(1H)-pyridinone
CasNumber: 929000-87-3
MolecularFormula: C13H10N2O2
MolecularWeight: 226.2307
MdlNumber: MFCD09258785
Smiles: COc1ccc(cc1)n1cccc(c1=O)C#N
Complexity: 408
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AB61935
ChemicalName:
2-Cyano-1-(4-methoxyphenyl)-2(1H)-pyridinone
CasNumber:
929000-87-3
MolecularFormula:
C13H10N2O2
MolecularWeight:
226.2307
MdlNumber:
MFCD09258785
Smiles:
COc1ccc(cc1)n1cccc(c1=O)C#N
Complexity:
408
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AB61936
ChemicalName: 2-Cyano-1,5-dimethylpyrrole-3-boronic acid, pinacol ester
CasNumber: 863868-49-9
MolecularFormula: C13H19BN2O2
MolecularWeight: 246.1132
MdlNumber: MFCD13195768
Smiles: N#Cc1c(cc(n1C)C)B1OC(C(O1)(C)C)(C)C
Complexity: 372
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB61936
ChemicalName:
2-Cyano-1,5-dimethylpyrrole-3-boronic acid, pinacol ester
CasNumber:
863868-49-9
MolecularFormula:
C13H19BN2O2
MolecularWeight:
246.1132
MdlNumber:
MFCD13195768
Smiles:
N#Cc1c(cc(n1C)C)B1OC(C(O1)(C)C)(C)C
Complexity:
372
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=C1CCCCC1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)C(=C1CCCCC1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCCCCCCCCCCSC(=S)SC(C#N)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCCCCCCCCCSC(=S)SC(C#N)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__