1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea
TL;DR: 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea (CAS 894574-75-5) is a chemical compound with molecular formula C16H14Cl2N4O4S and molecular weight 428.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea
Also Known As: 1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea, 1-(2-(2,4-DICHLOROPHENOXY)PROPIONYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE, 2-(2,4-dichlorophenoxy)-N-{[(4-nitrophenyl)carbamothioyl]amino}propanamide, 3-[2-(2,4-dichlorophenoxy)propanoylamino]-1-(4-nitrophenyl)thiourea, 2-[2-(2,4-dichlorophenoxy)propanoyl]-N-(4-nitrophenyl)-1-hydrazinecarbothioamide
| Molecular Formula | C16H14Cl2N4O4S |
|---|---|
| Molecular Weight | 428.01 g/mol |
| LogP | 3.6867 |
| Topological Polar Surface Area | 105.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.0113 |
| Heavy Atoms | 27 |
| Complexity | 863.99884 |
Chemical Identifiers
| CAS Number | 894574-75-5 |
|---|---|
| SMILES | CC(C(=O)NNC(=S)NC1=CC=C(C=C1)[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl |
Product Overview
1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea (CAS 894574-75-5), with molecular formula C16H14Cl2N4O4S and molecular weight 428.01 g/mol. IUPAC: 1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea
Property Insights of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea
The XLogP value of 3.6867 indicates that 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea has 3 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-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea?
The CAS number of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea is 894574-75-5.
What is the molecular formula of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea?
The molecular formula of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea is C16H14Cl2N4O4S.
What is the molecular weight of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea?
The molecular weight of 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea is 428.01 g/mol.
Where can I buy 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea?
You can request a quote for 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)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-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(2,4-Dichlorophenoxy)propanoylamino]-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.