N-[4-methyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4-methyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
N-[4-methyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V026-3122 |
| Compound Name: | N-[4-methyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 473.52 |
| Molecular Formula: | C24 H22 F3 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC1=CSC(=N/C(c2cccc(c2)C(F)(F)F)=O)\N1Cc1ccc(cc1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3836 |
| logD: | 4.3836 |
| logSw: | -4.3739 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.359 |
| InChI Key: | CGDREBXNKCLWTN-UHFFFAOYSA-N |