TL;DR: Tamoxifen analog II (CAS 59130-21-1) is a chemical compound with molecular formula C15H12Cl2 and molecular weight 262.03162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,2-dichloro-3-phenylcyclopropyl)benzene
Also Known As: Tamoxifen analog II, a.k.a. Analog II, Analog II, tamoxifen, 1,1-Dichloro-2,3-diphenylcyclopropane, diphenyldichlorocyclopropane
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H12Cl2 |
| Molecular Weight | 262.03162 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.03162 Da |
| Heavy Atoms | 17 |
| Complexity | 236.0 |
| SMILES | C1=CC=C(C=C1)C2C(C2(Cl)Cl)C3=CC=CC=C3 |
| InChIKey | DJDNTZDWSNETAS-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that Tamoxifen analog II is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tamoxifen analog II exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tamoxifen analog II has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tamoxifen analog II is 59130-21-1.
The molecular formula of Tamoxifen analog II is C15H12Cl2.
The molecular weight of Tamoxifen analog II is 262.03162 g/mol.
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