Crl 40634
TL;DR: Crl 40634 (CAS 70585-59-0) is a chemical compound with molecular formula C16H24ClNO4 and molecular weight 329.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hydroxy-2,6-dimethoxyphenyl)-4-pyrrolidin-1-ylbutan-1-one;hydrochloride
Also Known As: Crl 40634, 4-Desmethylbuflomedil HCl, NIOSH/EL7632000, 4-Desmethylbuflomedil hydrochloride, 4-Desmethyl buflomedil hydrochloride
| Molecular Formula | C16H24ClNO4 |
|---|---|
| Molecular Weight | 329.14 g/mol |
| LogP | 2.8899 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.13937 |
| Heavy Atoms | 22 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 70585-59-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1C(=O)CCCN2CCCC2)OC)O.Cl |
| InChIKey | FUYNGWCGSJHNDN-UHFFFAOYSA-N |
Product Overview
Crl 40634 (CAS 70585-59-0), with molecular formula C16H24ClNO4 and molecular weight 329.14 g/mol. IUPAC: 1-(4-hydroxy-2,6-dimethoxyphenyl)-4-pyrrolidin-1-ylbutan-1-one;hydrochloride.
Chemical Property Profile of Crl 40634
Property Insights of Crl 40634
The XLogP value of 2.8899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Crl 40634. With a topological polar surface area (TPSA) of 59.0 Ų, Crl 40634 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Crl 40634 has 2 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 Crl 40634?
The CAS number of Crl 40634 is 70585-59-0.
What is the molecular formula of Crl 40634?
The molecular formula of Crl 40634 is C16H24ClNO4.
What is the molecular weight of Crl 40634?
The molecular weight of Crl 40634 is 329.14 g/mol.
Where can I buy Crl 40634?
You can request a quote for Crl 40634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crl 40634?
Yes, KEHONG BIO provides custom synthesis services for Crl 40634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.