Carmoxirole
TL;DR: Carmoxirole (CAS 98323-83-2) is a chemical compound with molecular formula C24H26N2O2 and molecular weight 374.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indole-5-carboxylic acid
Also Known As: CARMOXIROLE, Carmoxirol, Carmoxirolum, Carmoxirole [INN], carmoxirole hydrochloride
| Molecular Formula | C24H26N2O2 |
|---|---|
| Molecular Weight | 374.20 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 56.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.19943 |
| Heavy Atoms | 28 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 98323-83-2 |
|---|---|
| SMILES | C1CN(CC=C1C2=CC=CC=C2)CCCCC3=CNC4=C3C=C(C=C4)C(=O)O |
| InChIKey | AFSOIHMEOKEZJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carmoxirole (CAS 98323-83-2), with molecular formula C24H26N2O2 and molecular weight 374.20 g/mol. IUPAC: 3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indole-5-carboxylic acid.
Chemical Property Profile of Carmoxirole
Property Insights of Carmoxirole
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carmoxirole. With a topological polar surface area (TPSA) of 56.3 Ų, Carmoxirole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carmoxirole has 2 hydrogen bond donor(s) and 3 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 Carmoxirole?
The CAS number of Carmoxirole is 98323-83-2.
What is the molecular formula of Carmoxirole?
The molecular formula of Carmoxirole is C24H26N2O2.
What is the molecular weight of Carmoxirole?
The molecular weight of Carmoxirole is 374.20 g/mol.
Where can I buy Carmoxirole?
You can request a quote for Carmoxirole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carmoxirole?
Yes, KEHONG BIO provides custom synthesis services for Carmoxirole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.