AB00673097-01
TL;DR: AB00673097-01 (CAS 682783-71-7) is a chemical compound with molecular formula C17H13N3O5S2 and molecular weight 403.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide
Also Known As: AB00673097-01, F1063-1879, 3-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide, 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide, 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide
| Molecular Formula | C17H13N3O5S2 |
|---|---|
| Molecular Weight | 403.03 g/mol |
| LogP | 3.4178 |
| Topological Polar Surface Area | 105.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.02966 |
| Heavy Atoms | 27 |
| Complexity | 922.55536 |
Chemical Identifiers
| CAS Number | 682783-71-7 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/2\C(=O)N(C(=S)S2)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
AB00673097-01 (CAS 682783-71-7), with molecular formula C17H13N3O5S2 and molecular weight 403.03 g/mol. IUPAC: 3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide.
Chemical Property Profile of AB00673097-01
Property Insights of AB00673097-01
The XLogP value of 3.4178 indicates that AB00673097-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673097-01. Following Lipinski's Rule of Five, AB00673097-01 has 1 hydrogen bond donor(s) and 7 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 AB00673097-01?
The CAS number of AB00673097-01 is 682783-71-7.
What is the molecular formula of AB00673097-01?
The molecular formula of AB00673097-01 is C17H13N3O5S2.
What is the molecular weight of AB00673097-01?
The molecular weight of AB00673097-01 is 403.03 g/mol.
Where can I buy AB00673097-01?
You can request a quote for AB00673097-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673097-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673097-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.