AB01302780-01
TL;DR: AB01302780-01 (CAS 903863-14-9) is a chemical compound with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-(2-hydroxyethyl)oxamide
Also Known As: AB01302780-01, N'-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-(2-hydroxyethyl)oxamide, N-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-(2-hydroxyethyl)ethanediamide, N1-(3-cyano-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)-N2-(2-hydroxyethyl)oxalamide
| Molecular Formula | C14H17N3O4S |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 0.51808 |
| Topological Polar Surface Area | 111.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.09396 |
| Heavy Atoms | 22 |
| Complexity | 645.24854 |
Chemical Identifiers
| CAS Number | 903863-14-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC(=C2C#N)NC(=O)C(=O)NCCO)C |
Product Overview
AB01302780-01 (CAS 903863-14-9), with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol. IUPAC: N'-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-(2-hydroxyethyl)oxamide.
Chemical Property Profile of AB01302780-01
Property Insights of AB01302780-01
The XLogP value of 0.51808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01302780-01. The TPSA of 111.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01302780-01. Following Lipinski's Rule of Five, AB01302780-01 has 3 hydrogen bond donor(s) and 6 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 AB01302780-01?
The CAS number of AB01302780-01 is 903863-14-9.
What is the molecular formula of AB01302780-01?
The molecular formula of AB01302780-01 is C14H17N3O4S.
What is the molecular weight of AB01302780-01?
The molecular weight of AB01302780-01 is 323.09 g/mol.
Where can I buy AB01302780-01?
You can request a quote for AB01302780-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01302780-01?
Yes, KEHONG BIO provides custom synthesis services for AB01302780-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.