ethyl 1-{3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
ethyl 1-{3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V024-6267 |
| Compound Name: | ethyl 1-{3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate |
| Molecular Weight: | 631.84 |
| Molecular Formula: | C35 H45 N5 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)C(c1cccc(CSc2nc(cc(n2)N2CCN(CC2)c2ccc(cc2)OC)C(C)(C)C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7652 |
| logD: | 6.7645 |
| logSw: | -5.6085 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.316 |
| InChI Key: | OGLHOWKTLBZJJR-MHZLTWQESA-N |