AA88336
165683-01-2 | 2-Anilino-1,3-thiazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA88336
ChemicalName
2-Anilino-1,3-thiazole-4-carboxylic acid
CasNumber
165683-01-2
MolecularFormula
C10H8N2O2S
MolecularWeight
220.2477
MdlNumber
MFCD04117336
Smiles
OC(=O)c1csc(n1)Nc1ccccc1
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AA88336
ChemicalName: 2-Anilino-1,3-thiazole-4-carboxylic acid
CasNumber: 165683-01-2
MolecularFormula: C10H8N2O2S
MolecularWeight: 220.2477
MdlNumber: MFCD04117336
Smiles: OC(=O)c1csc(n1)Nc1ccccc1
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AA88336
ChemicalName:
2-Anilino-1,3-thiazole-4-carboxylic acid
CasNumber:
165683-01-2
MolecularFormula:
C10H8N2O2S
MolecularWeight:
220.2477
MdlNumber:
MFCD04117336
Smiles:
OC(=O)c1csc(n1)Nc1ccccc1
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: AA88337
ChemicalName: O4I2
CasNumber: 165682-93-9
MolecularFormula: C12H11ClN2O2S
MolecularWeight: 282.74593999999996
MdlNumber: MFCD08166530
Smiles: CCOC(=O)c1csc(n1)Nc1ccc(cc1)Cl
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4
CatalogNumber:
AA88337
ChemicalName:
O4I2
CasNumber:
165682-93-9
MolecularFormula:
C12H11ClN2O2S
MolecularWeight:
282.74593999999996
MdlNumber:
MFCD08166530
Smiles:
CCOC(=O)c1csc(n1)Nc1ccc(cc1)Cl
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4
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Smiles: [O-2].[O-2].[Mg+2].[Cr+4].[OH-].[OH-].O.O.O.O.O
Complexity: __
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Smiles:
[O-2].[O-2].[Mg+2].[Cr+4].[OH-].[OH-].O.O.O.O.O
Complexity:
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Smiles: CCOc1ccnc(c1)C#N
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Smiles:
CCOc1ccnc(c1)C#N
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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