CTK5H7321
TL;DR: CTK5H7321 (CAS 95036-97-8) is a chemical compound with molecular formula C19H20Cl2O3 and molecular weight 366.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2,6-dichloro-4-methoxy-3-methylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid
Also Known As: Ro 12-9933, Ro-12-9933, 9-(2,6-dichloro-4-methoxy-3-methylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid, (2E,4E,6E,8E)-9-(2,6-DICHLORO-4-METHOXY-3-METHYL-PHENYL)-3,7-DIMETHYL-NONA-2,4,6,8-TETRAENOIC ACID
| Molecular Formula | C19H20Cl2O3 |
|---|---|
| Molecular Weight | 366.08 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.07895 |
| Heavy Atoms | 24 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 95036-97-8 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1OC)Cl)C=CC(=CC=CC(=CC(=O)O)C)C)Cl |
| InChIKey | UIYDAJBSZLUITG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK5H7321 (CAS 95036-97-8), with molecular formula C19H20Cl2O3 and molecular weight 366.08 g/mol. IUPAC: 9-(2,6-dichloro-4-methoxy-3-methylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid.
Chemical Property Profile of CTK5H7321
Property Insights of CTK5H7321
The XLogP value of 6.6 indicates that CTK5H7321 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, CTK5H7321 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK5H7321 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK5H7321?
The CAS number of CTK5H7321 is 95036-97-8.
What is the molecular formula of CTK5H7321?
The molecular formula of CTK5H7321 is C19H20Cl2O3.
What is the molecular weight of CTK5H7321?
The molecular weight of CTK5H7321 is 366.08 g/mol.
Where can I buy CTK5H7321?
You can request a quote for CTK5H7321 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5H7321?
Yes, KEHONG BIO provides custom synthesis services for CTK5H7321 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.