N-cycloheptyl-N~2~-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonyl)-N~2~-methylglycinamide
Chemical Structure Depiction of
N-cycloheptyl-N~2~-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonyl)-N~2~-methylglycinamide
N-cycloheptyl-N~2~-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonyl)-N~2~-methylglycinamide
Compound characteristics
| Compound ID: | K906-3276 |
| Compound Name: | N-cycloheptyl-N~2~-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonyl)-N~2~-methylglycinamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C19 H26 N4 O5 S |
| Smiles: | CN(CC(NC1CCCCCC1)=O)S(c1ccc2c(c1)C(NCC(N2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7771 |
| logD: | 1.2439 |
| logSw: | -2.8845 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.494 |
| InChI Key: | IVXCCNDENBZCRO-UHFFFAOYSA-N |