N-[3-{[4-(ethylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[3-{[4-(ethylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
N-[3-{[4-(ethylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V014-0401 |
| Compound Name: | N-[3-{[4-(ethylcarbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CCNC(c1ccc(CN2C=CSC/2=N/C(c2ccc(c(c2)OC)OC)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6409 |
| logD: | 1.6409 |
| logSw: | -2.5805 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.442 |
| InChI Key: | RHLREVKKULZIDI-UHFFFAOYSA-N |