3-[3-(4-cyclohexylpiperazine-1-sulfonyl)-4-methylphenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Chemical Structure Depiction of
3-[3-(4-cyclohexylpiperazine-1-sulfonyl)-4-methylphenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
3-[3-(4-cyclohexylpiperazine-1-sulfonyl)-4-methylphenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Compound characteristics
| Compound ID: | L299-0473 |
| Compound Name: | 3-[3-(4-cyclohexylpiperazine-1-sulfonyl)-4-methylphenyl]-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C25 H33 N5 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCN(CC1)C1CCCCC1)(=O)=O)c1c(C)nn2C(CCC(Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.023 |
| logD: | 1.6586 |
| logSw: | -2.6767 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.217 |
| InChI Key: | IMSAGUJIIXOACO-UHFFFAOYSA-N |