N-benzyl-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-benzyl-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-benzyl-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: | L299-3747 |
| Compound Name: | N-benzyl-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: | 468.53 |
| Molecular Formula: | C23 H24 N4 O5 S |
| Smiles: | CCc1c(c2ccc(c(c2)S(NCc2ccccc2)(=O)=O)OC)c2NC(CCC(n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0327 |
| logD: | 1.7574 |
| logSw: | -2.9656 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.491 |
| InChI Key: | RJSPHROXQYZMOH-UHFFFAOYSA-N |