N-(2-ethyl-6-methylphenyl)-2-methoxy-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-ethyl-6-methylphenyl)-2-methoxy-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-ethyl-6-methylphenyl)-2-methoxy-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: | L299-1706 |
Compound Name: | N-(2-ethyl-6-methylphenyl)-2-methoxy-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: | 482.56 |
Molecular Formula: | C24 H26 N4 O5 S |
Smiles: | CCc1cccc(C)c1NS(c1cc(ccc1OC)c1c(C)nn2C(CCC(Nc12)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0898 |
logD: | 1.8047 |
logSw: | -2.8948 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 99.298 |
InChI Key: | IGKBPPNXBYJLIL-UHFFFAOYSA-N |