ethyl 1-(5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)piperidine-3-carboxylate
ethyl 1-(5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V024-9736 |
| Compound Name: | ethyl 1-(5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carbonyl)piperidine-3-carboxylate |
| Molecular Weight: | 617.69 |
| Molecular Formula: | C30 H34 F3 N5 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(CSc2nc(C)cc(n2)N2CCN(CC2)c2cccc(c2)C(F)(F)F)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1004 |
| logD: | 6.1002 |
| logSw: | -5.4835 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.42 |
| InChI Key: | CKOCWWNLZQZPGT-NRFANRHFSA-N |