AH13631
6639-57-2 | 1,3-Benzothiazole-2-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AH13631
ChemicalName
1,3-Benzothiazole-2-carbaldehyde
CasNumber
6639-57-2
MolecularFormula
C8H5NOS
MolecularWeight
163.1964
MdlNumber
MFCD00526215
Smiles
O=Cc1nc2c(s1)cccc2
NscNumber
49210
Complexity
162
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AH13631
ChemicalName: 1,3-Benzothiazole-2-carbaldehyde
CasNumber: 6639-57-2
MolecularFormula: C8H5NOS
MolecularWeight: 163.1964
MdlNumber: MFCD00526215
Smiles: O=Cc1nc2c(s1)cccc2
NscNumber: 49210
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AH13631
ChemicalName:
1,3-Benzothiazole-2-carbaldehyde
CasNumber:
6639-57-2
MolecularFormula:
C8H5NOS
MolecularWeight:
163.1964
MdlNumber:
MFCD00526215
Smiles:
O=Cc1nc2c(s1)cccc2
NscNumber:
49210
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ncc2c(c1)cccc2
NscNumber: __
Complexity: 205
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ncc2c(c1)cccc2
NscNumber:
__
Complexity:
205
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCN(c1ccncc1)CCCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCN(c1ccncc1)CCCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH13634
ChemicalName: Benzothiazole-5-carboxylic acid
CasNumber: 68867-17-4
MolecularFormula: C8H5NO2S
MolecularWeight: 179.1958
MdlNumber: MFCD06796380
Smiles: OC(=O)c1ccc2c(c1)ncs2
NscNumber: __
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AH13634
ChemicalName:
Benzothiazole-5-carboxylic acid
CasNumber:
68867-17-4
MolecularFormula:
C8H5NO2S
MolecularWeight:
179.1958
MdlNumber:
MFCD06796380
Smiles:
OC(=O)c1ccc2c(c1)ncs2
NscNumber:
__
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.5