AN-038/13744003
TL;DR: AN-038/13744003 (CAS 353484-32-9) is a chemical compound with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid
Also Known As: AN-038/13744003, 4-[(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid, 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid, 3-[(9-cyano-3,3-dimethyl-4-oxa-7-thiabicyclo[4.3.0]nona-8,10-dien-8-yl)carbamoyl]propanoic Acid, 4-((3-cyano-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)amino)-4-oxobutanoic acid
| Molecular Formula | C14H16N2O4S |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.27438 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.08307 |
| Heavy Atoms | 21 |
| Complexity | 627.65393 |
Chemical Identifiers
| CAS Number | 353484-32-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC(=C2C#N)NC(=O)CCC(=O)O)C |
Product Overview
AN-038/13744003 (CAS 353484-32-9), with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol. IUPAC: 4-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid.
Chemical Property Profile of AN-038/13744003
Property Insights of AN-038/13744003
The XLogP value of 2.27438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-038/13744003. The TPSA of 99.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-038/13744003. Following Lipinski's Rule of Five, AN-038/13744003 has 2 hydrogen bond donor(s) and 5 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-038/13744003?
The CAS number of AN-038/13744003 is 353484-32-9.
What is the molecular formula of AN-038/13744003?
The molecular formula of AN-038/13744003 is C14H16N2O4S.
What is the molecular weight of AN-038/13744003?
The molecular weight of AN-038/13744003 is 308.08 g/mol.
Where can I buy AN-038/13744003?
You can request a quote for AN-038/13744003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-038/13744003?
Yes, KEHONG BIO provides custom synthesis services for AN-038/13744003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.