2-(adamantan-1-yl)-4,4,4-trifluoro-1-[4-(1H-pyrrol-1-yl)phenyl]butane-1,3-dione
Chemical Structure Depiction of
2-(adamantan-1-yl)-4,4,4-trifluoro-1-[4-(1H-pyrrol-1-yl)phenyl]butane-1,3-dione
2-(adamantan-1-yl)-4,4,4-trifluoro-1-[4-(1H-pyrrol-1-yl)phenyl]butane-1,3-dione
Compound characteristics
| Compound ID: | 8012-9440 |
| Compound Name: | 2-(adamantan-1-yl)-4,4,4-trifluoro-1-[4-(1H-pyrrol-1-yl)phenyl]butane-1,3-dione |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C24 H24 F3 N O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(C(c1ccc(cc1)n1cccc1)=O)C(C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7872 |
| logD: | 5.7871 |
| logSw: | -6.0308 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.4633 |
| InChI Key: | RBLRFWJHRWQNQJ-LZGZYFLISA-N |