5-[(adamantan-1-yl)imino]-3,3-dimethyl-4-(thiomorpholin-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2-thione
Chemical Structure Depiction of
5-[(adamantan-1-yl)imino]-3,3-dimethyl-4-(thiomorpholin-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2-thione
5-[(adamantan-1-yl)imino]-3,3-dimethyl-4-(thiomorpholin-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2-thione
Compound characteristics
| Compound ID: | F208-0399 |
| Compound Name: | 5-[(adamantan-1-yl)imino]-3,3-dimethyl-4-(thiomorpholin-4-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2-thione |
| Molecular Weight: | 521.71 |
| Molecular Formula: | C27 H34 F3 N3 S2 |
| Smiles: | CC1(C)C(\C(=N/C23CC4CC(CC(C4)C3)C2)N(C1=S)c1cccc(c1)C(F)(F)F)N1CCSCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0052 |
| logD: | 7.0051 |
| logSw: | -6.0824 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 13.1542 |
| InChI Key: | ZXKSKPYXOAIOSL-OMQIJLIKSA-N |