N-butyl-N,2-dimethyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-butyl-N,2-dimethyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
N-butyl-N,2-dimethyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-0532 |
| Compound Name: | N-butyl-N,2-dimethyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C20 H26 N4 O4 S |
| Smiles: | CCCCN(C)S(c1cc(ccc1C)c1c(C)nn2C(CCC(Nc12)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9016 |
| logD: | 1.6164 |
| logSw: | -2.7675 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.227 |
| InChI Key: | ITCJKVUXQQRPTO-UHFFFAOYSA-N |