N-[2-(4-chlorophenyl)ethyl]-4-ethyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-ethyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
N-[2-(4-chlorophenyl)ethyl]-4-ethyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | M057-2101 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-ethyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 359.88 |
| Molecular Formula: | C18 H18 Cl N3 O S |
| Smiles: | CCc1c(C(NCCc2ccc(cc2)[Cl])=O)sc(n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.459 |
| logD: | 4.4541 |
| logSw: | -4.6095 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.565 |
| InChI Key: | RAFOFUFOKCXVON-UHFFFAOYSA-N |