4-(benzenesulfonyl)-1-(3-chloro-4-methylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-(3-chloro-4-methylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
4-(benzenesulfonyl)-1-(3-chloro-4-methylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Compound characteristics
Compound ID: | E646-2676 |
Compound Name: | 4-(benzenesulfonyl)-1-(3-chloro-4-methylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide |
Molecular Weight: | 492.04 |
Molecular Formula: | C24 H30 Cl N3 O4 S |
Smiles: | CC(C)CCNC(C1(C)CN(CC(N1c1ccc(C)c(c1)[Cl])=O)S(c1ccccc1)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2424 |
logD: | 4.2423 |
logSw: | -4.4529 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.783 |
InChI Key: | BVSJQSVMFXLEFU-DEOSSOPVSA-N |