8-(5-chlorothiophene-2-sulfonyl)-2-(2-methylpropyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(5-chlorothiophene-2-sulfonyl)-2-(2-methylpropyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(5-chlorothiophene-2-sulfonyl)-2-(2-methylpropyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0626 |
| Compound Name: | 8-(5-chlorothiophene-2-sulfonyl)-2-(2-methylpropyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 419.95 |
| Molecular Formula: | C16 H22 Cl N3 O4 S2 |
| Smiles: | CC(C)CN1CC(N2CCN(CCC2C1=O)S(c1ccc(s1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8871 |
| logD: | 1.8871 |
| logSw: | -2.6638 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.443 |
| InChI Key: | WOVVHRVJFSAMQF-GFCCVEGCSA-N |