2-ethyl-3-[4-methyl-3-(4-methylpiperidine-1-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Chemical Structure Depiction of
2-ethyl-3-[4-methyl-3-(4-methylpiperidine-1-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
2-ethyl-3-[4-methyl-3-(4-methylpiperidine-1-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Compound characteristics
| Compound ID: | L299-2429 |
| Compound Name: | 2-ethyl-3-[4-methyl-3-(4-methylpiperidine-1-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | CCc1c(c2ccc(C)c(c2)S(N2CCC(C)CC2)(=O)=O)c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4689 |
| logD: | 2.1936 |
| logSw: | -2.8484 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.813 |
| InChI Key: | JIGSUANRUWZWMX-UHFFFAOYSA-N |