methyl 5-(propan-2-yl)-2-[(2S)-2-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(propan-2-yl)-2-[(2S)-2-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
methyl 5-(propan-2-yl)-2-[(2S)-2-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y044-4838 |
| Compound Name: | methyl 5-(propan-2-yl)-2-[(2S)-2-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 321.4 |
| Molecular Formula: | C15 H19 N3 O3 S |
| Smiles: | CC(C)c1c(C(=O)OC)nc(NC([C@H](C)n2cccc2)=O)s1 |
| Stereo: | ABSOLUTE |
| logP: | 3.0966 |
| logD: | 2.9521 |
| logSw: | -3.312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.53 |
| InChI Key: | VIYPFUUPBHPKDW-JTQLQIEISA-N |