2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-0411 |
| Compound Name: | 2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H21 N5 O4 S |
| Smiles: | Cc1ccc(cc1S(NCc1ccccn1)(=O)=O)c1c(C)nn2C(CCC(Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8009 |
| logD: | 0.511 |
| logSw: | -2.4894 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.715 |
| InChI Key: | YEPWJLSWDQQVMV-UHFFFAOYSA-N |