N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide
TL;DR: N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide (CAS 13097-08-0) is a chemical compound with molecular formula C9H7N3O2S2 and molecular weight 253.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)pyridine-4-carboxamide
Also Known As: Nicotineaminorhodanine, 3-isonicotinamido-rhodanine, NIOSH/NS0600000, 4-Pyridinecarboxamide, N-(4-oxo-2-thioxo-3-thiazolidinyl)-, N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide
| Molecular Formula | C9H7N3O2S2 |
|---|---|
| Molecular Weight | 253.00 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.99797 |
| Heavy Atoms | 16 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 13097-08-0 |
|---|---|
| SMILES | C1C(=O)N(C(=S)S1)NC(=O)C2=CC=NC=C2 |
| InChIKey | PJRSYKJVEBWMKO-UHFFFAOYSA-N |
Product Overview
N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide (CAS 13097-08-0), with molecular formula C9H7N3O2S2 and molecular weight 253.00 g/mol. IUPAC: N-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)pyridine-4-carboxamide.
Chemical Property Profile of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide
Property Insights of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide. Following Lipinski's Rule of Five, N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide 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 N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide?
The CAS number of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide is 13097-08-0.
What is the molecular formula of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide?
The molecular formula of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide is C9H7N3O2S2.
What is the molecular weight of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide?
The molecular weight of N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide is 253.00 g/mol.
Where can I buy N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide?
You can request a quote for N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Oxo-2-thioxo-3-thiazolidinyl)-4-pyridinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.