BRL-16644 free base
2-[[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydrochromen-7-yl]oxy]-N,N-dimethylethanamine
| Molecular Formula | C22H26F3NO2 |
|---|---|
| Molecular Weight | 393.4 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 21.7 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.19156 |
| Heavy Atoms | 28 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 65512-99-4 |
|---|---|
| SMILES | CC1(CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F)C |
| InChIKey | JXMMPZKBOUKGPG-UHFFFAOYSA-N |
📖 Product Overview
BRL-16644 free base (CAS: 65512-99-4) is a chemical compound with molecular formula C22H26F3NO2 and molecular weight 393.4 g/mol. Its IUPAC systematic name is 2-[[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydrochromen-7-yl]oxy]-N,N-dimethylethanamine.
JXMMPZKBOUKGPG-UHFFFAOYSA-N.
SMILES: CC1(CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F)C.
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