8-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0067 |
| Compound Name: | 8-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 411.91 |
| Molecular Formula: | C18 H22 Cl N3 O4 S |
| Smiles: | C1CN(CCN2CCNC(C12)=O)C(C1(CC1)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4764 |
| logD: | 0.419 |
| logSw: | -2.6729 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.48 |
| InChI Key: | BBXIGEMYLWELTC-OAHLLOKOSA-N |