ChemDiv1_009344
TL;DR: ChemDiv1_009344 (CAS 370854-33-4) is a chemical compound with molecular formula C25H23N3O5S and molecular weight 477.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)-2-pyridinyl]sulfanyl]acetate
Also Known As: ChemDiv1_009344, methyl {[3-cyano-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate, methyl 2-((3-cyano-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl)thio)acetate, methyl 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanylacetate, METHYL 2-{[3-CYANO-4-(3,4-DIMETHOXYPHENYL)-6-METHYL-5-(PHENYLCARBAMOYL)PYRIDIN-2-YL]SULFANYL}ACETATE
| Molecular Formula | C25H23N3O5S |
|---|---|
| Molecular Weight | 477.14 g/mol |
| LogP | 4.4633 |
| Topological Polar Surface Area | 110.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 477.13583 |
| Heavy Atoms | 34 |
| Complexity | 1255.6414 |
Chemical Identifiers
| CAS Number | 370854-33-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)SCC(=O)OC)C#N)C2=CC(=C(C=C2)OC)OC)C(=O)NC3=CC=CC=C3 |
Product Overview
ChemDiv1_009344 (CAS 370854-33-4), with molecular formula C25H23N3O5S and molecular weight 477.14 g/mol. IUPAC: methyl 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)-2-pyridinyl]sulfanyl]acetate.
Chemical Property Profile of ChemDiv1_009344
Property Insights of ChemDiv1_009344
The XLogP value of 4.4633 indicates that ChemDiv1_009344 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009344. Following Lipinski's Rule of Five, ChemDiv1_009344 has 1 hydrogen bond donor(s) and 8 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 ChemDiv1_009344?
The CAS number of ChemDiv1_009344 is 370854-33-4.
What is the molecular formula of ChemDiv1_009344?
The molecular formula of ChemDiv1_009344 is C25H23N3O5S.
What is the molecular weight of ChemDiv1_009344?
The molecular weight of ChemDiv1_009344 is 477.14 g/mol.
Where can I buy ChemDiv1_009344?
You can request a quote for ChemDiv1_009344 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009344?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009344 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.