Basic information
- Standard SMILES
Cc1nc(C(=O)Nc2cc(-c3cccc(C(=O)O)c3)cc3[nH]ncc23)cs1- InChIKey
KTIXFUFECWCPRU-UHFFFAOYSA-N- Molecular formula
- C19H14N4O3S
- Average molar mass
- 378.4 g/mol
- Monoisotopic mass
- 378.07866149
Names & identifiers
- Preferred name
- 3-(4-{[(2-Methyl-1,3-thiazol-4-yl)carbonyl]amino}-1H-indazol-6-yl)benzoic acid
- IUPAC
- 3-[4-[(2-methyl-1,3-thiazole-4-carbonyl)amino]-1H-indazol-6-yl]benzoic acid
Names & synonyms
SCHEMBL1118857KTIXFUFECWCPRU-UHFFFAOYSA-N3-(4-{[(2-Methyl-1,3-thiazol-4-yl)carbonyl]amino}-1H-indazol-6-yl)benzoic acid
Database identifiers
- PubChem CID
- 44540213
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 577
Related reactions
2 records
Compound notes
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