ethyl 2-{5-[(3S)-1,2-dithiolan-3-yl]pentanamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{5-[(3S)-1,2-dithiolan-3-yl]pentanamido}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{5-[(3S)-1,2-dithiolan-3-yl]pentanamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y043-3734 |
| Compound Name: | ethyl 2-{5-[(3S)-1,2-dithiolan-3-yl]pentanamido}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 374.54 |
| Molecular Formula: | C15 H22 N2 O3 S3 |
| Smiles: | CCOC(c1c(C)nc(NC(CCCC[C@H]2CCSS2)=O)s1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.74 |
| logD: | 3.6635 |
| logSw: | -3.7634 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.051 |
| InChI Key: | FBPSRWYMGASBAN-NSHDSACASA-N |