Levophta; R 50547
TL;DR: Levophta; R 50547 (CAS 79449-98-2) is a chemical compound with molecular formula C26H29FN2O2 and molecular weight 420.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S)-1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenylpiperidine-4-carboxylic acid
Also Known As: levocabastine, Cabastine, Cabastinum, Cabastine [INN], Levophta; R 50547
| Molecular Formula | C26H29FN2O2 |
|---|---|
| Molecular Weight | 420.22 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.2213 |
| Heavy Atoms | 31 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 79449-98-2 |
|---|---|
| SMILES | C[C@H]1CN(CC[C@]1(C2=CC=CC=C2)C(=O)O)C3CCC(CC3)(C#N)C4=CC=C(C=C4)F |
| InChIKey | ZCGOMHNNNFPNMX-TUXHGLMRSA-N |
Product Overview
Levophta; R 50547 (CAS 79449-98-2), with molecular formula C26H29FN2O2 and molecular weight 420.22 g/mol. IUPAC: (3R,4S)-1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenylpiperidine-4-carboxylic acid.
Chemical Property Profile of Levophta; R 50547
Property Insights of Levophta; R 50547
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Levophta; R 50547. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Levophta; R 50547. Following Lipinski's Rule of Five, Levophta; R 50547 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Levophta; R 50547?
The CAS number of Levophta; R 50547 is 79449-98-2.
What is the molecular formula of Levophta; R 50547?
The molecular formula of Levophta; R 50547 is C26H29FN2O2.
What is the molecular weight of Levophta; R 50547?
The molecular weight of Levophta; R 50547 is 420.22 g/mol.
Where can I buy Levophta; R 50547?
You can request a quote for Levophta; R 50547 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Levophta; R 50547?
Yes, KEHONG BIO provides custom synthesis services for Levophta; R 50547 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.