RefChem:1071527
TL;DR: RefChem:1071527 (CAS 72732-41-3) is a chemical compound with molecular formula C14H9N3O3S2 and molecular weight 331.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
Also Known As: N-(5-(2-Furanylmethylene)-4-oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide, 4-Pyridinecarboxamide, N-(5-(2-furanylmethylene)-4-oxo-2-thioxo-3-thiazolidinyl)-, N-(5-(Furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)isonicotinamide, N-[ -5- -4-oxo-2-sulfanylidene-thiazolidin-3-yl]pyridine-4-carboxamide, N-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
| Molecular Formula | C14H9N3O3S2 |
|---|---|
| Molecular Weight | 331.01 g/mol |
| LogP | 2.2208 |
| Topological Polar Surface Area | 75.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.00854 |
| Heavy Atoms | 22 |
| Complexity | 756.90497 |
Chemical Identifiers
| CAS Number | 72732-41-3 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/2\C(=O)N(C(=S)S2)NC(=O)C3=CC=NC=C3 |
Product Overview
RefChem:1071527 (CAS 72732-41-3), with molecular formula C14H9N3O3S2 and molecular weight 331.01 g/mol. IUPAC: N-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pyridine-4-carboxamide.
Chemical Property Profile of RefChem:1071527
Property Insights of RefChem:1071527
The XLogP value of 2.2208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1071527. The TPSA of 75.44 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071527. Following Lipinski's Rule of Five, RefChem:1071527 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 RefChem:1071527?
The CAS number of RefChem:1071527 is 72732-41-3.
What is the molecular formula of RefChem:1071527?
The molecular formula of RefChem:1071527 is C14H9N3O3S2.
What is the molecular weight of RefChem:1071527?
The molecular weight of RefChem:1071527 is 331.01 g/mol.
Where can I buy RefChem:1071527?
You can request a quote for RefChem:1071527 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071527?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071527 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.