5-[(3-chlorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
5-[(3-chlorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-(propan-2-yl)pyrimidine
5-[(3-chlorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V027-1514 |
| Compound Name: | 5-[(3-chlorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-(propan-2-yl)pyrimidine |
| Molecular Weight: | 467.03 |
| Molecular Formula: | C22 H31 Cl N4 O3 S |
| Salt: | not_available |
| Smiles: | CCS(N1CCN(CC1)c1c(Cc2cccc(c2)[Cl])c(COC)nc(C(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4523 |
| logD: | 4.3568 |
| logSw: | -4.5289 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.298 |
| InChI Key: | PJNCDMGYFZWAPZ-UHFFFAOYSA-N |