1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide
TL;DR: 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide (CAS 74270-70-5) is a chemical compound with molecular formula C14H14N4OS and molecular weight 286.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-(pyridine-4-carbonylamino)thiourea
Also Known As: 1-Ittsc, 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide, 1-(2-methylphenyl)-3-(pyridine-4-carbonylamino)thiourea, 1-Isonicotinoyl-4-(ortho-tolyl)thiosemicarbazide, 2-isonicotinoyl-N-(o-tolyl)hydrazinecarbothioamide
| Molecular Formula | C14H14N4OS |
|---|---|
| Molecular Weight | 286.09 g/mol |
| LogP | 2.02142 |
| Topological Polar Surface Area | 66.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.08884 |
| Heavy Atoms | 20 |
| Complexity | 615.5808 |
Chemical Identifiers
| CAS Number | 74270-70-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NNC(=O)C2=CC=NC=C2 |
Product Overview
1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide (CAS 74270-70-5), with molecular formula C14H14N4OS and molecular weight 286.09 g/mol. IUPAC: 1-(2-methylphenyl)-3-(pyridine-4-carbonylamino)thiourea.
Chemical Property Profile of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide
Property Insights of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide
The XLogP value of 2.02142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide. The TPSA of 66.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide. Following Lipinski's Rule of Five, 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide has 3 hydrogen bond donor(s) and 3 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 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide?
The CAS number of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide is 74270-70-5.
What is the molecular formula of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide?
The molecular formula of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide is C14H14N4OS.
What is the molecular weight of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide?
The molecular weight of 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide is 286.09 g/mol.
Where can I buy 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide?
You can request a quote for 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-Isonicotinoyl-4-(2-tolyl)thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.