5-({2-[(2-chlorobenzoyl)imino]-4,5-dimethyl-1,3-thiazol-3(2H)-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
5-({2-[(2-chlorobenzoyl)imino]-4,5-dimethyl-1,3-thiazol-3(2H)-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}furan-2-carboxamide
5-({2-[(2-chlorobenzoyl)imino]-4,5-dimethyl-1,3-thiazol-3(2H)-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | V015-1712 |
| Compound Name: | 5-({2-[(2-chlorobenzoyl)imino]-4,5-dimethyl-1,3-thiazol-3(2H)-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 547.98 |
| Molecular Formula: | C26 H21 Cl F3 N3 O3 S |
| Smiles: | CC1=C(C)SC(=N/C(c2ccccc2[Cl])=O)\N1Cc1ccc(C(NCc2cccc(c2)C(F)(F)F)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.3983 |
| logD: | 5.3983 |
| logSw: | -5.7584 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.014 |
| InChI Key: | OFFRMEJQVRCBBT-UHFFFAOYSA-N |