5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-(3-ethylphenyl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-(3-ethylphenyl)-2-methylbenzene-1-sulfonamide
5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-(3-ethylphenyl)-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-5977 |
| Compound Name: | 5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-(3-ethylphenyl)-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C25 H28 N4 O4 S |
| Smiles: | CCCc1c(c2ccc(C)c(c2)S(Nc2cccc(CC)c2)(=O)=O)c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9606 |
| logD: | 3.6853 |
| logSw: | -4.119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.752 |
| InChI Key: | TYKSTRMMSQVZAP-UHFFFAOYSA-N |