4-(3-methylphenyl)-6-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
Chemical Structure Depiction of
4-(3-methylphenyl)-6-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
4-(3-methylphenyl)-6-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
Compound characteristics
| Compound ID: | F727-0054 |
| Compound Name: | 4-(3-methylphenyl)-6-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C25 H30 N4 O2 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCN(CC1)c1cc(c2cccc(C)c2)ncn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2038 |
| logD: | 6.1975 |
| logSw: | -5.6758 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.211 |
| InChI Key: | SHBCNIWSAHKWRP-UHFFFAOYSA-N |