![1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea structure](/static/products/7019/701929-76-2.webp)
1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea
TL;DR: 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea (CAS 701929-76-2) is a chemical compound with molecular formula C15H13F2N5O3S2 and molecular weight 413.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea
Also Known As: 1-(2,4-difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea, 3-[(2,4-difluorophenyl)thiocarbamoylamino]-1-(2-methoxy-4-nitro-phenyl)thiourea, N-(2,4-difluorophenyl)-N'-(2-methoxy-4-nitrophenyl)hydrazine-1,2-dicarbothioamide, [(2,4-difluorophenyl)amino](2-{[(2-methoxy-4-nitrophenyl)amino]thioxomethyl}hy drazino)methane-1-thione
| Molecular Formula | C15H13F2N5O3S2 |
|---|---|
| Molecular Weight | 413.04 g/mol |
| LogP | 3.0696 |
| Topological Polar Surface Area | 100.49 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.0428 |
| Heavy Atoms | 27 |
| Complexity | 897.7513 |
Chemical Identifiers
| CAS Number | 701929-76-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=S)NC2=C(C=C(C=C2)F)F |
Product Overview
1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea (CAS 701929-76-2), with molecular formula C15H13F2N5O3S2 and molecular weight 413.04 g/mol. IUPAC: 1-(2,4-difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea.
Chemical Property Profile of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea
Property Insights of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea
The XLogP value of 3.0696 indicates that 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea. Following Lipinski's Rule of Five, 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea has 4 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 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea?
The CAS number of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea is 701929-76-2.
What is the molecular formula of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea?
The molecular formula of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea is C15H13F2N5O3S2.
What is the molecular weight of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea?
The molecular weight of 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea is 413.04 g/mol.
Where can I buy 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea?
You can request a quote for 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Difluorophenyl)-3-[(2-methoxy-4-nitrophenyl)carbamothioylamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.