AB70973
56278-50-3 | Benzothiazole-2-acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB70973
ChemicalName
Benzothiazole-2-acetonitrile
CasNumber
56278-50-3
MolecularFormula
C9H6N2S
MolecularWeight
174.2223
MdlNumber
MFCD00051633
Smiles
N#CCc1nc2c(s1)cccc2
NscNumber
379416
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB70973
ChemicalName: Benzothiazole-2-acetonitrile
CasNumber: 56278-50-3
MolecularFormula: C9H6N2S
MolecularWeight: 174.2223
MdlNumber: MFCD00051633
Smiles: N#CCc1nc2c(s1)cccc2
NscNumber: 379416
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB70973
ChemicalName:
Benzothiazole-2-acetonitrile
CasNumber:
56278-50-3
MolecularFormula:
C9H6N2S
MolecularWeight:
174.2223
MdlNumber:
MFCD00051633
Smiles:
N#CCc1nc2c(s1)cccc2
NscNumber:
379416
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB70974
ChemicalName: Benzo[4,5]thieno[2,3-b]quinoxaline
CasNumber: 243-69-6
MolecularFormula: C14H8N2S
MolecularWeight: 236.2917
MdlNumber: MFCD18449120
Smiles: c1ccc2c(c1)nc1c(n2)sc2c1cccc2
NscNumber: 129364
Complexity: 296
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 3.7
CatalogNumber:
AB70974
ChemicalName:
Benzo[4,5]thieno[2,3-b]quinoxaline
CasNumber:
243-69-6
MolecularFormula:
C14H8N2S
MolecularWeight:
236.2917
MdlNumber:
MFCD18449120
Smiles:
c1ccc2c(c1)nc1c(n2)sc2c1cccc2
NscNumber:
129364
Complexity:
296
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClS(=O)(=O)c1csc2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClS(=O)(=O)c1csc2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OS(=O)(=O)c1cccc2c1nn[nH]2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OS(=O)(=O)c1cccc2c1nn[nH]2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__