![N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide structure](/static/products/2153/21531-83-9.webp)
N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide
TL;DR: N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide (CAS 21531-83-9) is a chemical compound with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide
Also Known As: N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide, N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide, 1-isonicotinoyl-4-benzoyl-3-thiosemicarbazide, J1.061.014A, 1-(4-PYRIDINECARBONYL)-4-BENZOYLTHIOSEMICARBAZIDE
| Molecular Formula | C14H12N4O2S |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 1.0309 |
| Topological Polar Surface Area | 83.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.06808 |
| Heavy Atoms | 21 |
| Complexity | 646.53827 |
Chemical Identifiers
| CAS Number | 21531-83-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2 |
Product Overview
N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide (CAS 21531-83-9), with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol. IUPAC: N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide.
Chemical Property Profile of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide
Property Insights of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide
The XLogP value of 1.0309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide. The TPSA of 83.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide. Following Lipinski's Rule of Five, N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide has 3 hydrogen bond donor(s) and 4 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-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide?
The CAS number of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide is 21531-83-9.
What is the molecular formula of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide?
The molecular formula of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide is C14H12N4O2S.
What is the molecular weight of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide?
The molecular weight of N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide is 300.07 g/mol.
Where can I buy N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide?
You can request a quote for N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[(phenylformamido)methanethioyl]amino}pyridine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.