N-[(2-chlorophenyl)methyl]-2-methyl-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-[(2-chlorophenyl)methyl]-2-methyl-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-[(2-chlorophenyl)methyl]-2-methyl-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: | L299-0425 |
Compound Name: | N-[(2-chlorophenyl)methyl]-2-methyl-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: | 472.95 |
Molecular Formula: | C22 H21 Cl N4 O4 S |
Smiles: | Cc1ccc(cc1S(NCc1ccccc1[Cl])(=O)=O)c1c(C)nn2C(CCC(Nc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5864 |
logD: | 2.3013 |
logSw: | -3.717 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.171 |
InChI Key: | KJKILLKTOKWTEA-UHFFFAOYSA-N |