ethyl 1-(3-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
ethyl 1-(3-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V011-8255 |
| Compound Name: | ethyl 1-(3-{[(4-tert-butyl-6-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}pyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate |
| Molecular Weight: | 634.84 |
| Molecular Formula: | C35 H46 N4 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)C(c1cccc(CSc2nc(cc(n2)N(C)CCc2ccc(c(c2)OC)OC)C(C)(C)C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0624 |
| logD: | 6.0553 |
| logSw: | -5.3705 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.253 |
| InChI Key: | HFFQKABOAIFJJP-MHZLTWQESA-N |