2-(3,4-difluorobenzoyl)-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(3,4-difluorobenzoyl)-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(3,4-difluorobenzoyl)-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-1018 |
| Compound Name: | 2-(3,4-difluorobenzoyl)-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C19 H25 F2 N3 O3 S |
| Smiles: | CN1CCN(CC1)CC1CCS(C12CN(C2)C(c1ccc(c(c1)F)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7454 |
| logD: | -0.1091 |
| logSw: | -2.1852 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.106 |
| InChI Key: | HLJKGJRXZBLCBA-HNNXBMFYSA-N |