N-butyl-5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N,2-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-butyl-5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N,2-dimethylbenzene-1-sulfonamide
N-butyl-5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N,2-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-5974 |
| Compound Name: | N-butyl-5-(5,8-dioxo-2-propyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N,2-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C22 H30 N4 O4 S |
| Smiles: | CCCCN(C)S(c1cc(ccc1C)c1c(CCC)nn2C(CCC(Nc12)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1406 |
| logD: | 2.8653 |
| logSw: | -3.4271 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.916 |
| InChI Key: | BFQBEPQMJNFSIT-UHFFFAOYSA-N |