ethyl 2-{2-[1-(1H-pyrrol-1-yl)cyclohexyl]acetamido}-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[1-(1H-pyrrol-1-yl)cyclohexyl]acetamido}-1,3-thiazole-4-carboxylate
ethyl 2-{2-[1-(1H-pyrrol-1-yl)cyclohexyl]acetamido}-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y042-6062 |
| Compound Name: | ethyl 2-{2-[1-(1H-pyrrol-1-yl)cyclohexyl]acetamido}-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C18 H23 N3 O3 S |
| Smiles: | CCOC(c1csc(NC(CC2(CCCCC2)n2cccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.734 |
| logD: | 3.6976 |
| logSw: | -3.7649 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.683 |
| InChI Key: | DDWBAHBOOWPHBW-UHFFFAOYSA-N |