CV-6504.Hcl
TL;DR: CV-6504.Hcl (CAS 117585-83-8) is a chemical compound with molecular formula C15H16ClNO2 and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5-trimethyl-6-(pyridin-3-ylmethyl)cyclohexa-2,5-diene-1,4-dione;hydrochloride
Also Known As: CV-6504.HCL, 2,3,5-trimethyl-6-(pyridin-3-ylmethyl)cyclohexa-2,5-diene-1,4-dione Hydrochloride, 3,5,6-trimethyl-2-(3-pyridylmethyl)-1,4-benzoquinone hydrochloride, 2,3,5-Trimethyl-6-(3-pyridylmethyl)-2,5-cyclohexane-1,4-dione hydrochloride
| Molecular Formula | C15H16ClNO2 |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 2.8506 |
| Topological Polar Surface Area | 47.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.08694 |
| Heavy Atoms | 19 |
| Complexity | 585.423 |
Chemical Identifiers
| CAS Number | 117585-83-8 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)C)CC2=CN=CC=C2)C.Cl |
Product Overview
CV-6504.Hcl (CAS 117585-83-8), with molecular formula C15H16ClNO2 and molecular weight 277.09 g/mol. IUPAC: 2,3,5-trimethyl-6-(pyridin-3-ylmethyl)cyclohexa-2,5-diene-1,4-dione;hydrochloride.
Chemical Property Profile of CV-6504.Hcl
Property Insights of CV-6504.Hcl
The XLogP value of 2.8506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CV-6504.Hcl. With a topological polar surface area (TPSA) of 47.03 Ų, CV-6504.Hcl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CV-6504.Hcl has 0 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 CV-6504.Hcl?
The CAS number of CV-6504.Hcl is 117585-83-8.
What is the molecular formula of CV-6504.Hcl?
The molecular formula of CV-6504.Hcl is C15H16ClNO2.
What is the molecular weight of CV-6504.Hcl?
The molecular weight of CV-6504.Hcl is 277.09 g/mol.
Where can I buy CV-6504.Hcl?
You can request a quote for CV-6504.Hcl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CV-6504.Hcl?
Yes, KEHONG BIO provides custom synthesis services for CV-6504.Hcl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.