AB00685501-01
TL;DR: AB00685501-01 (CAS 682764-06-3) is a chemical compound with molecular formula C17H15N3O3S2 and molecular weight 373.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-pyridin-2-ylbutanamide
Also Known As: AB00685501-01, F1063-2040, (E)-4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(pyridin-2-yl)butanamide, 4-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(pyridin-2-yl)butanamide, 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-pyridin-2-ylbutanamide
| Molecular Formula | C17H15N3O3S2 |
|---|---|
| Molecular Weight | 373.06 g/mol |
| LogP | 3.2947 |
| Topological Polar Surface Area | 75.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.05548 |
| Heavy Atoms | 25 |
| Complexity | 803.81024 |
Chemical Identifiers
| CAS Number | 682764-06-3 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=O)CCCN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
Product Overview
AB00685501-01 (CAS 682764-06-3), with molecular formula C17H15N3O3S2 and molecular weight 373.06 g/mol. IUPAC: 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-pyridin-2-ylbutanamide.
Chemical Property Profile of AB00685501-01
Property Insights of AB00685501-01
The XLogP value of 3.2947 indicates that AB00685501-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.44 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685501-01. Following Lipinski's Rule of Five, AB00685501-01 has 1 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 AB00685501-01?
The CAS number of AB00685501-01 is 682764-06-3.
What is the molecular formula of AB00685501-01?
The molecular formula of AB00685501-01 is C17H15N3O3S2.
What is the molecular weight of AB00685501-01?
The molecular weight of AB00685501-01 is 373.06 g/mol.
Where can I buy AB00685501-01?
You can request a quote for AB00685501-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685501-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685501-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.