2-[(4-fluorophenyl)methyl]-8-(propane-1-sulfonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-8-(propane-1-sulfonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-8-(propane-1-sulfonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0821 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-8-(propane-1-sulfonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 383.48 |
| Molecular Formula: | C18 H26 F N3 O3 S |
| Smiles: | CCCS(N1CCC2C(N(CCN2CC1)Cc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2352 |
| logD: | 1.2352 |
| logSw: | -2.2548 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.031 |
| InChI Key: | BDRPUNTUCFOSIF-QGZVFWFLSA-N |