4-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-(3-methylphenyl)pyrimidine
Chemical Structure Depiction of
4-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-(3-methylphenyl)pyrimidine
4-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-(3-methylphenyl)pyrimidine
Compound characteristics
Compound ID: | F727-0059 |
Compound Name: | 4-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-(3-methylphenyl)pyrimidine |
Molecular Weight: | 428.94 |
Molecular Formula: | C21 H21 Cl N4 O2 S |
Smiles: | Cc1cccc(c1)c1cc(ncn1)N1CCN(CC1)S(c1cccc(c1)[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1178 |
logD: | 5.1115 |
logSw: | -5.5853 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 54.211 |
InChI Key: | YPERDTXXCBTQGF-UHFFFAOYSA-N |