Seldane-D
TL;DR: Seldane-D (CAS 123245-78-3) is a chemical compound with molecular formula C42H57ClN2O3 and molecular weight 672.40576 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol;(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride
Also Known As: Seldane-D, alpha-(4-(1,1-Dimethylethyl)phenyl)-4-(hydroxydiphenylmethyl)-1-piperidinebutanol mixt. with (S-(R*,R*))-alpha-(1-(methylamino)ethyl)benzenemethanol hydrochloride, 1-Piperidinebutanol, alpha-(4-(1,1-dimethylethyl)phenyl)-4-(hydroxydiphenylmethyl)-, mixt. with (S-(R*,R*))-alpha-(1-(methylamino)ethyl)benzenemethanol hydrochloride, (1S,2S)-2-(Methylamino)-1-phenylpropan-1-ol--1-(4-tert-butylphenyl)-4-{4-[hydroxydi(phenyl)methyl]piperidin-1-yl}butan-1-ol--hydrogen chloride (1/1/1), 1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol; (1S,2S)-2-(methylamino)-1-phenylpropan-1-ol; hydrochloride
Technical Specifications
| Molecular Formula | C42H57ClN2O3 |
| Molecular Weight | 672.40576 g/mol |
| XLogP | 8.1955 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 672.40576 Da |
| Heavy Atoms | 48 |
| Complexity | 703.0 |
| SMILES | C[C@@H]([C@H](C1=CC=CC=C1)O)NC.CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O.Cl |
| InChIKey | ZMKDJNCMGOQKLZ-MNIONDOCSA-N |
Chemical Property Profile of Seldane-D
Property Insights of Seldane-D
The XLogP value of 8.1955 indicates that Seldane-D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Seldane-D. Following Lipinski's Rule of Five, Seldane-D has 5 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Seldane-D?
The CAS number of Seldane-D is 123245-78-3.
What is the molecular formula of Seldane-D?
The molecular formula of Seldane-D is C42H57ClN2O3.
What is the molecular weight of Seldane-D?
The molecular weight of Seldane-D is 672.40576 g/mol.
Where can I buy Seldane-D?
You can request a quote for Seldane-D directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Seldane-D?
Yes, CoreyChem provides custom synthesis services for Seldane-D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.