N-[4,5-dimethyl-3-{[4-(methylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-{[4-(methylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
N-[4,5-dimethyl-3-{[4-(methylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V005-2022 |
| Compound Name: | N-[4,5-dimethyl-3-{[4-(methylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | CC1=C(C)SC(=N/C(c2cccc(c2)OC)=O)\N1Cc1ccc(cc1)C(NC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1792 |
| logD: | 3.1792 |
| logSw: | -3.3701 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.139 |
| InChI Key: | DYFGBPBPWUETRF-UHFFFAOYSA-N |