N-benzyl-N-methyl-4-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}benzamide
Chemical Structure Depiction of
N-benzyl-N-methyl-4-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}benzamide
N-benzyl-N-methyl-4-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}benzamide
Compound characteristics
| Compound ID: | V026-6613 |
| Compound Name: | N-benzyl-N-methyl-4-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}benzamide |
| Molecular Weight: | 591.7 |
| Molecular Formula: | C32 H32 F3 N5 O S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1ccc(cc1)C(N(C)Cc1ccccc1)=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.694 |
| logD: | 6.6937 |
| logSw: | -5.8439 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.393 |
| InChI Key: | LNNZIWYETUTWNQ-UHFFFAOYSA-N |