methyl 5-benzyl-2-[3-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-benzyl-2-[3-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
methyl 5-benzyl-2-[3-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y044-5133 |
| Compound Name: | methyl 5-benzyl-2-[3-(1H-pyrrol-1-yl)propanamido]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C19 H19 N3 O3 S |
| Smiles: | COC(c1c(Cc2ccccc2)sc(NC(CCn2cccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7436 |
| logD: | 3.7055 |
| logSw: | -4.0076 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.896 |
| InChI Key: | UALUELAOJRWZGW-UHFFFAOYSA-N |