AN-153/14542025
TL;DR: AN-153/14542025 (CAS 329212-69-3) is a chemical compound with molecular formula C13H16N2OS and molecular weight 248.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethyl-3,3-dimethyl-6-oxo-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: AN-153/14542025, 8-ethyl-3,3-dimethyl-6-oxo-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 8-ethyl-3,3-dimethyl-6-oxo-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 8-ethyl-3,3-dimethyl-6-oxo-7-hydro-1H,4H-thiano[5,4-c]pyridine-5-carbonitrile
| Molecular Formula | C13H16N2OS |
|---|---|
| Molecular Weight | 248.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.09833 |
| Heavy Atoms | 17 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 329212-69-3 |
|---|---|
| SMILES | CCC1=C2CSC(CC2=C(C(=O)N1)C#N)(C)C |
| InChIKey | FCSUVJWYIHCWKI-UHFFFAOYSA-N |
Product Overview
AN-153/14542025 (CAS 329212-69-3), with molecular formula C13H16N2OS and molecular weight 248.10 g/mol. IUPAC: 8-ethyl-3,3-dimethyl-6-oxo-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of AN-153/14542025
Property Insights of AN-153/14542025
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-153/14542025. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-153/14542025. Following Lipinski's Rule of Five, AN-153/14542025 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 AN-153/14542025?
The CAS number of AN-153/14542025 is 329212-69-3.
What is the molecular formula of AN-153/14542025?
The molecular formula of AN-153/14542025 is C13H16N2OS.
What is the molecular weight of AN-153/14542025?
The molecular weight of AN-153/14542025 is 248.10 g/mol.
Where can I buy AN-153/14542025?
You can request a quote for AN-153/14542025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-153/14542025?
Yes, KEHONG BIO provides custom synthesis services for AN-153/14542025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.