methyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(methoxycarbonyl)amino]alaninate
Chemical Structure Depiction of
methyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(methoxycarbonyl)amino]alaninate
methyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(methoxycarbonyl)amino]alaninate
Compound characteristics
| Compound ID: | 3448-8306 |
| Compound Name: | methyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(methoxycarbonyl)amino]alaninate |
| Molecular Weight: | 379.36 |
| Molecular Formula: | C14 H16 F3 N3 O4 S |
| Smiles: | CCc1c(C#N)c(NC(C(=O)OC)(C(F)(F)F)NC(=O)OC)sc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1835 |
| logD: | 2.2131 |
| logSw: | -3.3855 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.324 |
| InChI Key: | BZPPRZBFQKRNRD-ZDUSSCGKSA-N |