ethyl 1-[5-({[4-(4-acetylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carbonyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[5-({[4-(4-acetylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carbonyl]piperidine-3-carboxylate
ethyl 1-[5-({[4-(4-acetylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carbonyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V024-9040 |
| Compound Name: | ethyl 1-[5-({[4-(4-acetylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carbonyl]piperidine-3-carboxylate |
| Molecular Weight: | 545.66 |
| Molecular Formula: | C26 H35 N5 O6 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)C(C)=O)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0844 |
| logD: | 3.0843 |
| logSw: | -3.1202 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.468 |
| InChI Key: | MHOPXGLYHNWTJI-IBGZPJMESA-N |