CI 946; Go 4942; Goe 4942; PD 117818
TL;DR: CI 946; Go 4942; Goe 4942; PD 117818 (CAS 1089085-40-4) is a chemical compound with molecular formula C13H13ClN2O2S and molecular weight 296.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-6-methylphenyl)-2-(3-methyl-4-oxo-1,3-thiazolidin-2-ylidene)acetamide
Also Known As: Ralitoline, CI 946; Go 4942; Goe 4942; PD 117818
| Molecular Formula | C13H13ClN2O2S |
|---|---|
| Molecular Weight | 296.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.03864 |
| Heavy Atoms | 19 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 1089085-40-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)C=C2N(C(=O)CS2)C |
| InChIKey | YJXQTIXFPYPQFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CI 946; Go 4942; Goe 4942; PD 117818 (CAS 1089085-40-4), with molecular formula C13H13ClN2O2S and molecular weight 296.04 g/mol. IUPAC: N-(2-chloro-6-methylphenyl)-2-(3-methyl-4-oxo-1,3-thiazolidin-2-ylidene)acetamide.
Chemical Property Profile of CI 946; Go 4942; Goe 4942; PD 117818
Property Insights of CI 946; Go 4942; Goe 4942; PD 117818
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CI 946; Go 4942; Goe 4942; PD 117818. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for CI 946; Go 4942; Goe 4942; PD 117818. Following Lipinski's Rule of Five, CI 946; Go 4942; Goe 4942; PD 117818 has 1 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 CI 946; Go 4942; Goe 4942; PD 117818?
The CAS number of CI 946; Go 4942; Goe 4942; PD 117818 is 1089085-40-4.
What is the molecular formula of CI 946; Go 4942; Goe 4942; PD 117818?
The molecular formula of CI 946; Go 4942; Goe 4942; PD 117818 is C13H13ClN2O2S.
What is the molecular weight of CI 946; Go 4942; Goe 4942; PD 117818?
The molecular weight of CI 946; Go 4942; Goe 4942; PD 117818 is 296.04 g/mol.
Where can I buy CI 946; Go 4942; Goe 4942; PD 117818?
You can request a quote for CI 946; Go 4942; Goe 4942; PD 117818 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CI 946; Go 4942; Goe 4942; PD 117818?
Yes, KEHONG BIO provides custom synthesis services for CI 946; Go 4942; Goe 4942; PD 117818 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.