Basic information
- Standard SMILES
Cc1nc(Nc2ccccc2)sc1C(=O)O- InChIKey
LNBUJXLOYNNILV-UHFFFAOYSA-N- Molecular formula
- C11H10N2O2S
- Average molar mass
- 234.28 g/mol
- Monoisotopic mass
- 234.04629874
Names & identifiers
- Preferred name
- 4-Methyl-2-(phenylamino)-1,3-thiazole-5-carboxylic acid
- IUPAC
- 2-anilino-4-methyl-1,3-thiazole-5-carboxylic acid
Names & synonyms
436094-60-94-methyl-2-(phenylamino)-1,3-thiazole-5-carboxylic acid4-methyl-2-(phenylamino)thiazole-5-carboxylic acid2-anilino-4-methyl-1,3-thiazole-5-carboxylic AcidSCHEMBL4765972LNBUJXLOYNNILV-UHFFFAOYSA-NSTL253455AKOS002391856MS-9600FM169330CS-0279515EN300-145109
Show more names
F6870074-methyl-2-(N-phenylamino)thiazole-5-carboxylic acid4-methyl-2-(phenylamino)-1,3-thiazole-5-carboxylicacid
Database identifiers
- PubChem CID
- 1132679
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 256
Related reactions
2 records
Compound notes
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