ethyl 1-(4-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
ethyl 1-(4-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V024-9747 |
| Compound Name: | ethyl 1-(4-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate |
| Molecular Weight: | 634.84 |
| Molecular Formula: | C35 H46 N4 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(CSc2nc(cc(n2)N(C)CCc2ccc(c(c2)OC)OC)C(C)(C)C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8184 |
| logD: | 5.8113 |
| logSw: | -5.3716 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.32 |
| InChI Key: | CZXJSSRHNVHQJZ-UHFFFAOYSA-N |