ChemDiv1_028523
TL;DR: ChemDiv1_028523 (CAS 369396-46-3) is a chemical compound with molecular formula C25H22ClN5O5S and molecular weight 539.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-N-(4-chloro-2,5-dimethoxyphenyl)-5-cyano-4-(3,4-dimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Also Known As: ChemDiv1_028523, 3,6-diamino-N-(4-chloro-2,5-dimethoxyphenyl)-5-cyano-4-(3,4-dimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide, F1155-0218, N-(4-chloro-2,5-dimethoxyphenyl)-3,6-diamino-5-cyano-4-(3,4-dimethoxyphenyl)-1-thia-7-aza-2-indenecarboxamide
| Molecular Formula | C25H22ClN5O5S |
|---|---|
| Molecular Weight | 539.10 g/mol |
| LogP | 4.93948 |
| Topological Polar Surface Area | 154.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.103 |
| Heavy Atoms | 37 |
| Complexity | 1580.7129 |
Chemical Identifiers
| CAS Number | 369396-46-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NC4=CC(=C(C=C4OC)Cl)OC)N)N)C#N)OC |
Product Overview
ChemDiv1_028523 (CAS 369396-46-3), with molecular formula C25H22ClN5O5S and molecular weight 539.10 g/mol. IUPAC: 3,6-diamino-N-(4-chloro-2,5-dimethoxyphenyl)-5-cyano-4-(3,4-dimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide.
Chemical Property Profile of ChemDiv1_028523
Property Insights of ChemDiv1_028523
The XLogP value of 4.93948 indicates that ChemDiv1_028523 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.74 Ų indicates high polarity, suggesting ChemDiv1_028523 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_028523 has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_028523?
The CAS number of ChemDiv1_028523 is 369396-46-3.
What is the molecular formula of ChemDiv1_028523?
The molecular formula of ChemDiv1_028523 is C25H22ClN5O5S.
What is the molecular weight of ChemDiv1_028523?
The molecular weight of ChemDiv1_028523 is 539.10 g/mol.
Where can I buy ChemDiv1_028523?
You can request a quote for ChemDiv1_028523 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028523?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028523 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.