3-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Chemical Structure Depiction of
3-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
3-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Compound characteristics
| Compound ID: | L299-2444 |
| Compound Name: | 3-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C25 H26 N4 O4 S |
| Smiles: | CCc1c(c2ccc(C)c(c2)S(N2CCc3ccccc3C2)(=O)=O)c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0338 |
| logD: | 2.7585 |
| logSw: | -3.3991 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.475 |
| InChI Key: | ZWSKGATUWHAYER-UHFFFAOYSA-N |