N-[2-(4-bromobenzamido)ethyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-bromobenzamido)ethyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide
N-[2-(4-bromobenzamido)ethyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V010-1161 |
| Compound Name: | N-[2-(4-bromobenzamido)ethyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 516.46 |
| Molecular Formula: | C24 H26 Br N3 O3 S |
| Smiles: | CC(C)c1ccc(C)cc1OCc1nc(cs1)C(NCCNC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2868 |
| logD: | 5.2868 |
| logSw: | -5.2102 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.835 |
| InChI Key: | MCHQSVIMRFFQIK-UHFFFAOYSA-N |