5-[(3-chlorophenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
5-[(3-chlorophenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
5-[(3-chlorophenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V027-1538 |
| Compound Name: | 5-[(3-chlorophenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine |
| Molecular Weight: | 481.06 |
| Molecular Formula: | C23 H33 Cl N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCS(N1CCN(CC1)c1c(Cc2cccc(c2)[Cl])c(COC)nc(C(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7986 |
| logD: | 4.7031 |
| logSw: | -4.8282 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.298 |
| InChI Key: | QRKQPLTUBXEDKQ-UHFFFAOYSA-N |