N-(3-bromophenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-bromophenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
N-(3-bromophenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M459-0896 |
| Compound Name: | N-(3-bromophenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 484.42 |
| Molecular Formula: | C22 H22 Br N5 O S |
| Smiles: | C1CN(CCN1c1ccccc1)c1ccnc(n1)SCC(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2625 |
| logD: | 5.2624 |
| logSw: | -5.363 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.018 |
| InChI Key: | AKHURDGMQFGSHO-UHFFFAOYSA-N |