1-{4-[2-({[5-(4-acetylpiperazine-1-carbonyl)furan-2-yl]methyl}sulfanyl)-6-(methoxymethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-({[5-(4-acetylpiperazine-1-carbonyl)furan-2-yl]methyl}sulfanyl)-6-(methoxymethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
1-{4-[2-({[5-(4-acetylpiperazine-1-carbonyl)furan-2-yl]methyl}sulfanyl)-6-(methoxymethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V003-4587 |
| Compound Name: | 1-{4-[2-({[5-(4-acetylpiperazine-1-carbonyl)furan-2-yl]methyl}sulfanyl)-6-(methoxymethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C24 H32 N6 O5 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)C(C)=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.778 |
| logD: | 1.7779 |
| logSw: | -2.2993 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.976 |
| InChI Key: | ZLMCPOMKDWRMKJ-UHFFFAOYSA-N |