N-(3-acetylphenyl)-5-(2-ethyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-2-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-5-(2-ethyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-2-methoxybenzene-1-sulfonamide
N-(3-acetylphenyl)-5-(2-ethyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-2-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-3660 |
| Compound Name: | N-(3-acetylphenyl)-5-(2-ethyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-2-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 496.54 |
| Molecular Formula: | C24 H24 N4 O6 S |
| Smiles: | CCc1c(c2ccc(c(c2)S(Nc2cccc(c2)C(C)=O)(=O)=O)OC)c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8465 |
| logD: | 0.8756 |
| logSw: | -2.6962 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.209 |
| InChI Key: | CBJVDTBDYUUHMD-UHFFFAOYSA-N |