methyl 5-(2-phenylethyl)-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(2-phenylethyl)-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-4-carboxylate
methyl 5-(2-phenylethyl)-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y042-7461 |
| Compound Name: | methyl 5-(2-phenylethyl)-2-{2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamido}-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C24 H27 N3 O4 S |
| Smiles: | COC(c1c(CCc2ccccc2)sc(NC(CC2(CCOCC2)n2cccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5858 |
| logD: | 4.2962 |
| logSw: | -4.5379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.51 |
| InChI Key: | WPKPHQZFYLMGHZ-UHFFFAOYSA-N |