ChemDiv3_002878
TL;DR: ChemDiv3_002878 (CAS 366827-90-9) is a chemical compound with molecular formula C13H9Cl2NO5S and molecular weight 360.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,6-dichloro-4-[(Z)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
Also Known As: ChemDiv3_002878, AB00105314-01, BRD-K51052200-001-01-0, (Z)-2-(2,6-dichloro-4-((3-methyl-2,4-dioxothiazolidin-5-ylidene)methyl)phenoxy)acetic acid, {2,6-dichloro-4-[(Z)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid
| Molecular Formula | C13H9Cl2NO5S |
|---|---|
| Molecular Weight | 360.96 g/mol |
| LogP | 3.1229 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.95786 |
| Heavy Atoms | 22 |
| Complexity | 680.666 |
Chemical Identifiers
| CAS Number | 366827-90-9 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=CC(=C(C(=C2)Cl)OCC(=O)O)Cl)/SC1=O |
Product Overview
ChemDiv3_002878 (CAS 366827-90-9), with molecular formula C13H9Cl2NO5S and molecular weight 360.96 g/mol. IUPAC: 2-[2,6-dichloro-4-[(Z)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid.
Chemical Property Profile of ChemDiv3_002878
Property Insights of ChemDiv3_002878
The XLogP value of 3.1229 indicates that ChemDiv3_002878 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_002878. Following Lipinski's Rule of Five, ChemDiv3_002878 has 1 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 ChemDiv3_002878?
The CAS number of ChemDiv3_002878 is 366827-90-9.
What is the molecular formula of ChemDiv3_002878?
The molecular formula of ChemDiv3_002878 is C13H9Cl2NO5S.
What is the molecular weight of ChemDiv3_002878?
The molecular weight of ChemDiv3_002878 is 360.96 g/mol.
Where can I buy ChemDiv3_002878?
You can request a quote for ChemDiv3_002878 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_002878?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_002878 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.