ChemDiv1_008423
TL;DR: ChemDiv1_008423 (CAS 204775-50-8) is a chemical compound with molecular formula C19H25N3O4S and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]acetate
Also Known As: ChemDiv1_008423, DivK1c_003063, CDS1_002023, (5-Cyano-3,3-dimethyl-8-morpholin-4-yl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yls, ethyl {[5-cyano-3,3-dimethyl-8-(4-morpholinyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetate
| Molecular Formula | C19H25N3O4S |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 2.29638 |
| Topological Polar Surface Area | 84.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.1566 |
| Heavy Atoms | 27 |
| Complexity | 754.3021 |
Chemical Identifiers
| CAS Number | 204775-50-8 |
|---|---|
| SMILES | CCOC(=O)CSC1=C(C2=C(COC(C2)(C)C)C(=N1)N3CCOCC3)C#N |
Product Overview
ChemDiv1_008423 (CAS 204775-50-8), with molecular formula C19H25N3O4S and molecular weight 391.16 g/mol. IUPAC: ethyl 2-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]acetate.
Chemical Property Profile of ChemDiv1_008423
Property Insights of ChemDiv1_008423
The XLogP value of 2.29638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_008423. The TPSA of 84.68 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008423. Following Lipinski's Rule of Five, ChemDiv1_008423 has 0 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_008423?
The CAS number of ChemDiv1_008423 is 204775-50-8.
What is the molecular formula of ChemDiv1_008423?
The molecular formula of ChemDiv1_008423 is C19H25N3O4S.
What is the molecular weight of ChemDiv1_008423?
The molecular weight of ChemDiv1_008423 is 391.16 g/mol.
Where can I buy ChemDiv1_008423?
You can request a quote for ChemDiv1_008423 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008423?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008423 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.