AA94124
175277-27-7 | 6-Formyl-2-(methylsulfanyl)nicotinonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA94124
ChemicalName
6-Formyl-2-(methylsulfanyl)nicotinonitrile
CasNumber
175277-27-7
MolecularFormula
C8H6N2OS
MolecularWeight
178.211
MdlNumber
MFCD00173824
Smiles
CSc1nc(C=O)ccc1C#N
Complexity
210
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.2
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CatalogNumber: AA94124
ChemicalName: 6-Formyl-2-(methylsulfanyl)nicotinonitrile
CasNumber: 175277-27-7
MolecularFormula: C8H6N2OS
MolecularWeight: 178.211
MdlNumber: MFCD00173824
Smiles: CSc1nc(C=O)ccc1C#N
Complexity: 210
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.2
CatalogNumber:
AA94124
ChemicalName:
6-Formyl-2-(methylsulfanyl)nicotinonitrile
CasNumber:
175277-27-7
MolecularFormula:
C8H6N2OS
MolecularWeight:
178.211
MdlNumber:
MFCD00173824
Smiles:
CSc1nc(C=O)ccc1C#N
Complexity:
210
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C(C(=O)C)Sc1ncccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)C(C(=O)C)Sc1ncccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(c1ccc(c(=S)[nH]1)C#N)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(c1ccc(c(=S)[nH]1)C#N)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(C#N)c(=S)[nH]c1COC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(C#N)c(=S)[nH]c1COC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__