AB57001
4100-13-4 | 1,2,3-Thiadiazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB57001
ChemicalName
1,2,3-Thiadiazole-4-carboxylic acid
CasNumber
4100-13-4
MolecularFormula
C3H2N2O2S
MolecularWeight
130.1252
MdlNumber
MFCD00052099
Smiles
OC(=O)c1csnn1
NscNumber
521674
Complexity
108
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.3
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CatalogNumber: AB57001
ChemicalName: 1,2,3-Thiadiazole-4-carboxylic acid
CasNumber: 4100-13-4
MolecularFormula: C3H2N2O2S
MolecularWeight: 130.1252
MdlNumber: MFCD00052099
Smiles: OC(=O)c1csnn1
NscNumber: 521674
Complexity: 108
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.3
CatalogNumber:
AB57001
ChemicalName:
1,2,3-Thiadiazole-4-carboxylic acid
CasNumber:
4100-13-4
MolecularFormula:
C3H2N2O2S
MolecularWeight:
130.1252
MdlNumber:
MFCD00052099
Smiles:
OC(=O)c1csnn1
NscNumber:
521674
Complexity:
108
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Oc1c(cccc1OC(=O)C)OC(=O)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Oc1c(cccc1OC(=O)C)OC(=O)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(OC)cccc1OC
NscNumber: __
Complexity: 115
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(OC)cccc1OC
NscNumber:
__
Complexity:
115
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1c(C)cccc1C
NscNumber: __
Complexity: 76
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1c(C)cccc1C
NscNumber:
__
Complexity:
76
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.6