3-(2-chlorophenyl)-1-{4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}prop-2-en-1-one
Chemical Structure Depiction of
3-(2-chlorophenyl)-1-{4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}prop-2-en-1-one
3-(2-chlorophenyl)-1-{4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}prop-2-en-1-one
Compound characteristics
| Compound ID: | V006-0491 |
| Compound Name: | 3-(2-chlorophenyl)-1-{4-[4-(4-phenoxyphenyl)pyrimidin-2-yl]piperazin-1-yl}prop-2-en-1-one |
| Molecular Weight: | 497 |
| Molecular Formula: | C29 H25 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(/C=C/c1ccccc1[Cl])=O)c1nccc(c2ccc(cc2)Oc2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.7222 |
| logD: | 6.7221 |
| logSw: | -6.3509 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.026 |
| InChI Key: | XPQCYLOWQSSHTM-UHFFFAOYSA-N |