Basic information
- Standard SMILES
Cc1nc(-c2ccn[nH]2)sc1C(=O)NCc1cccnc1- InChIKey
VOMYHJXMICIBNF-UHFFFAOYSA-N- Molecular formula
- C14H13N5OS
- Average molar mass
- 299.35 g/mol
- Monoisotopic mass
- 299.08408123
Names & identifiers
- Preferred name
- 4-methyl-2-(2H-pyrazol-3-yl)-thiazole-5-carboxylic acid (pyridin-3-ylmethyl)-amide
- IUPAC
- 4-methyl-2-(1H-pyrazol-5-yl)-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide
Names & synonyms
VOMYHJXMICIBNF-UHFFFAOYSA-N4-methyl-2-(2H-pyrazol-3-yl)-thiazole-5-carboxylic acid (pyridin-3-ylmethyl)-amide4-methyl-2-(2H-pyrazol-3-yl)-thiazole-5-carboxylic acid (pyridine-3-ylmethyl)amide
Database identifiers
- PubChem CID
- 86645559
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 369
Related reactions
41 records
Compound notes
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