3-[4-chloro-3-(4-methylpiperazine-1-sulfonyl)phenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Chemical Structure Depiction of
3-[4-chloro-3-(4-methylpiperazine-1-sulfonyl)phenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
3-[4-chloro-3-(4-methylpiperazine-1-sulfonyl)phenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Compound characteristics
| Compound ID: | L299-0898 |
| Compound Name: | 3-[4-chloro-3-(4-methylpiperazine-1-sulfonyl)phenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C19 H22 Cl N5 O4 S |
| Smiles: | Cc1c(c2ccc(c(c2)S(N2CCN(C)CC2)(=O)=O)[Cl])c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1186 |
| logD: | -0.2292 |
| logSw: | -3.2018 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.601 |
| InChI Key: | KQESHCYBTHTIJC-UHFFFAOYSA-N |