4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-ethylbenzamide
Chemical Structure Depiction of
4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-ethylbenzamide
4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-ethylbenzamide
Compound characteristics
| Compound ID: | V024-9413 |
| Compound Name: | 4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-ethylbenzamide |
| Molecular Weight: | 491.66 |
| Molecular Formula: | C27 H33 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCNC(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)Cc2ccccc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7683 |
| logD: | 3.6612 |
| logSw: | -3.9372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.946 |
| InChI Key: | OGYCRAUFVSVCAM-UHFFFAOYSA-N |