4-[4-(3-chloro-4-methoxybenzene-1-sulfonyl)piperazin-1-yl]-6-methyl-2-(pyrrolidin-1-yl)pyrimidine
Chemical Structure Depiction of
4-[4-(3-chloro-4-methoxybenzene-1-sulfonyl)piperazin-1-yl]-6-methyl-2-(pyrrolidin-1-yl)pyrimidine
4-[4-(3-chloro-4-methoxybenzene-1-sulfonyl)piperazin-1-yl]-6-methyl-2-(pyrrolidin-1-yl)pyrimidine
Compound characteristics
| Compound ID: | D637-0014 |
| Compound Name: | 4-[4-(3-chloro-4-methoxybenzene-1-sulfonyl)piperazin-1-yl]-6-methyl-2-(pyrrolidin-1-yl)pyrimidine |
| Molecular Weight: | 451.97 |
| Molecular Formula: | C20 H26 Cl N5 O3 S |
| Smiles: | Cc1cc(nc(n1)N1CCCC1)N1CCN(CC1)S(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0879 |
| logD: | 4.0761 |
| logSw: | -4.3786 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.427 |
| InChI Key: | MOMGNLOOCKAHFE-UHFFFAOYSA-N |