Mdl 20646
TL;DR: Mdl 20646 (CAS 102830-64-8) is a chemical compound with molecular formula C14H10BrCl2NO and molecular weight 356.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
Also Known As: Mdl 20646, Mdl-20,646, 6-bromo-2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine, 6-Bromo-2-(3',4'-dichlorophenoxy)-2H-pyrano(2,3-b)pyridine, 2H-Pyrano(2,3-b)pyridine, 6-bromo-2-(3,4-dichlorophenyl)-3,4-dihydro-
| Molecular Formula | C14H10BrCl2NO |
|---|---|
| Molecular Weight | 356.93 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 22.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 356.93228 |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 102830-64-8 |
|---|---|
| SMILES | C1CC2=C(N=CC(=C2)Br)OC1C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | KPNRIVBFNMVMSS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mdl 20646 (CAS 102830-64-8), with molecular formula C14H10BrCl2NO and molecular weight 356.93 g/mol. IUPAC: 6-bromo-2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine.
Chemical Property Profile of Mdl 20646
Property Insights of Mdl 20646
The XLogP value of 5.0 indicates that Mdl 20646 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.1 Ų, Mdl 20646 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mdl 20646 has 0 hydrogen bond donor(s) and 2 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 Mdl 20646?
The CAS number of Mdl 20646 is 102830-64-8.
What is the molecular formula of Mdl 20646?
The molecular formula of Mdl 20646 is C14H10BrCl2NO.
What is the molecular weight of Mdl 20646?
The molecular weight of Mdl 20646 is 356.93 g/mol.
Where can I buy Mdl 20646?
You can request a quote for Mdl 20646 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mdl 20646?
Yes, KEHONG BIO provides custom synthesis services for Mdl 20646 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.