TL;DR: Dihydrotamoxifen (CAS 109640-20-2) is a chemical compound with molecular formula C26H31NO and molecular weight 373.24057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(1R,2R)-1,2-diphenylbutyl]phenoxy]-N,N-dimethylethanamine
Also Known As: Dihydrotamoxifen, 1-(4-(2-(Dimethylamino)ethoxy)phenyl)-1,2-diphenylbutane, (R*,R*)-2-(4-(1,2-Diphenylbutyl)phenoxy)-N,N-dimethylethanamine, 2-[4-[(1R,2R)-1,2-diphenylbutyl]phenoxy]-N,N-dimethylethanamine, 2-{4-[(1R,2R)-1,2-Diphenylbutyl]phenoxy}-N,N-dimethylethan-1-amine
| Molecular Formula | C26H31NO |
| Molecular Weight | 373.24057 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 373.24057 Da |
| Heavy Atoms | 28 |
| Complexity | 403.0 |
| SMILES | CC[C@@H](C1=CC=CC=C1)[C@H](C2=CC=CC=C2)C3=CC=C(C=C3)OCCN(C)C |
| InChIKey | YUFAHBUWIVNVNJ-IZZNHLLZSA-N |
The XLogP value of 6.5 indicates that Dihydrotamoxifen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Dihydrotamoxifen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydrotamoxifen has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dihydrotamoxifen is 109640-20-2.
The molecular formula of Dihydrotamoxifen is C26H31NO.
The molecular weight of Dihydrotamoxifen is 373.24057 g/mol.
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