2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide
TL;DR: 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide (CAS 20131-57-1) is a chemical compound with molecular formula C14H14N4O2S and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-(4-nitroanilino)thiourea
Also Known As: 1-(2-methylphenyl)-3-(4-nitroanilino)thiourea, 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide, 1-(p-nitrophenyl)-4-(o-tolyl)thiosemicarbazide, F0331-0256, N1-(2-methylphenyl)-2-(4-nitrophenyl)hydrazine-1-carbothioamide
| Molecular Formula | C14H14N4O2S |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 3.21672 |
| Topological Polar Surface Area | 79.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.08374 |
| Heavy Atoms | 21 |
| Complexity | 658.2785 |
Chemical Identifiers
| CAS Number | 20131-57-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide (CAS 20131-57-1), with molecular formula C14H14N4O2S and molecular weight 302.08 g/mol. IUPAC: 1-(2-methylphenyl)-3-(4-nitroanilino)thiourea.
Chemical Property Profile of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide
Property Insights of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide
The XLogP value of 3.21672 indicates that 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide 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 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide?
The CAS number of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide is 20131-57-1.
What is the molecular formula of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide?
The molecular formula of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide is C14H14N4O2S.
What is the molecular weight of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide?
The molecular weight of 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide is 302.08 g/mol.
Where can I buy 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide?
You can request a quote for 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-nitrophenyl)-N-(o-tolyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.