methyl 4-methyl-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 4-methyl-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-5-carboxylate
methyl 4-methyl-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y042-7431 |
| Compound Name: | methyl 4-methyl-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 363.43 |
| Molecular Formula: | C17 H21 N3 O4 S |
| Smiles: | Cc1c(C(=O)OC)sc(NC(CC2(CCOCC2)n2cccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4957 |
| logD: | 2.1856 |
| logSw: | -2.5982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.588 |
| InChI Key: | XQLYYOVIOKHFLE-UHFFFAOYSA-N |