methyl 5-(2-methylpropyl)-2-[4-(1H-pyrrol-1-yl)butanamido]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(2-methylpropyl)-2-[4-(1H-pyrrol-1-yl)butanamido]-1,3-thiazole-4-carboxylate
methyl 5-(2-methylpropyl)-2-[4-(1H-pyrrol-1-yl)butanamido]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-8448 |
| Compound Name: | methyl 5-(2-methylpropyl)-2-[4-(1H-pyrrol-1-yl)butanamido]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C17 H23 N3 O3 S |
| Smiles: | CC(C)Cc1c(C(=O)OC)nc(NC(CCCn2cccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2381 |
| logD: | 2.8172 |
| logSw: | -3.5492 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.168 |
| InChI Key: | QHLJSRGRRGCEFX-UHFFFAOYSA-N |