APE1 Inhibitor III
TL;DR: APE1 Inhibitor III (CAS 524708-03-0) is a chemical compound with molecular formula C19H21N3OS2 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]acetamide
Also Known As: APE1 Inhibitor III, N-(3-(benzo[d]thiazol-2-yl)-6-isopropyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide, N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]acetamide, BRD-K59114195-001-01-7, N-[3-(1,3-benzothiazol-2-yl)-6-isopropyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]acetamide
| Molecular Formula | C19H21N3OS2 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 4.7497 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.1126 |
| Heavy Atoms | 25 |
| Complexity | 908.4469 |
Chemical Identifiers
| CAS Number | 524708-03-0 |
|---|---|
| SMILES | CC(C)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C |
Product Overview
APE1 Inhibitor III (CAS 524708-03-0), with molecular formula C19H21N3OS2 and molecular weight 371.11 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]acetamide.
Chemical Property Profile of APE1 Inhibitor III
Property Insights of APE1 Inhibitor III
The XLogP value of 4.7497 indicates that APE1 Inhibitor III is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.23 Ų, APE1 Inhibitor III exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, APE1 Inhibitor III has 1 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 APE1 Inhibitor III?
The CAS number of APE1 Inhibitor III is 524708-03-0.
What is the molecular formula of APE1 Inhibitor III?
The molecular formula of APE1 Inhibitor III is C19H21N3OS2.
What is the molecular weight of APE1 Inhibitor III?
The molecular weight of APE1 Inhibitor III is 371.11 g/mol.
Where can I buy APE1 Inhibitor III?
You can request a quote for APE1 Inhibitor III directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for APE1 Inhibitor III?
Yes, KEHONG BIO provides custom synthesis services for APE1 Inhibitor III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.