3,4-dimethoxy-N-[3-{[3-({[3-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-[3-{[3-({[3-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
3,4-dimethoxy-N-[3-{[3-({[3-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V005-8006 |
| Compound Name: | 3,4-dimethoxy-N-[3-{[3-({[3-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 555.58 |
| Molecular Formula: | C28 H24 F3 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)C(/N=C1/N(Cc2cccc(c2)C(NCc2cccc(c2)C(F)(F)F)=O)C=CS1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8146 |
| logD: | 3.8146 |
| logSw: | -4.1622 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.544 |
| InChI Key: | HLHSYSHPXBDFHE-UHFFFAOYSA-N |