1-(4-fluoro-2-methylphenyl)-2-methyl-4-(4-methylbenzene-1-sulfonyl)-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
1-(4-fluoro-2-methylphenyl)-2-methyl-4-(4-methylbenzene-1-sulfonyl)-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
1-(4-fluoro-2-methylphenyl)-2-methyl-4-(4-methylbenzene-1-sulfonyl)-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-2779 |
| Compound Name: | 1-(4-fluoro-2-methylphenyl)-2-methyl-4-(4-methylbenzene-1-sulfonyl)-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C25 H32 F N3 O4 S |
| Smiles: | CC(C)CCNC(C1(C)CN(CC(N1c1ccc(cc1C)F)=O)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2756 |
| logD: | 4.2756 |
| logSw: | -4.1627 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.482 |
| InChI Key: | JWRCXSNISOAEBN-VWLOTQADSA-N |