5-[(2,5-dimethylphenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
5-[(2,5-dimethylphenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
5-[(2,5-dimethylphenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V003-3783 |
| Compound Name: | 5-[(2,5-dimethylphenyl)methyl]-4-(methoxymethyl)-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine |
| Molecular Weight: | 474.67 |
| Molecular Formula: | C25 H38 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCS(N1CCN(CC1)c1c(Cc2cc(C)ccc2C)c(COC)nc(C(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.267 |
| logD: | 4.8905 |
| logSw: | -5.2213 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.298 |
| InChI Key: | GTTKJBIJLHDUMS-UHFFFAOYSA-N |