1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide
TL;DR: 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide (CAS 894576-34-2) is a chemical compound with molecular formula C17H17Cl2N3O2S and molecular weight 397.04 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-methylphenyl)thiourea
Also Known As: 1-(2-(2,4-DICHLOROPHENOXY)PROPIONYL)-4-(4-METHYLPHENYL)THIOSEMICARBAZIDE, 1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(4-methylphenyl)thiourea, 2-(2,4-dichlorophenoxy)-N-{[(4-methylphenyl)carbamothioyl]amino}propanamide, 1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(p-tolyl)thiourea, 3-[2-(2,4-dichlorophenoxy)propanoylamino]-1-(4-methylphenyl)thiourea
| Molecular Formula | C17H17Cl2N3O2S |
|---|---|
| Molecular Weight | 397.04 g/mol |
| LogP | 4.08692 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.04184 |
| Heavy Atoms | 25 |
| Complexity | 768.98834 |
Chemical Identifiers
| CAS Number | 894576-34-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl |
Product Overview
1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide (CAS 894576-34-2), with molecular formula C17H17Cl2N3O2S and molecular weight 397.04 g/mol. IUPAC: 1-[2-(2,4-dichlorophenoxy)propanoylamino]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide
Property Insights of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide
The XLogP value of 4.08692 indicates that 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide. Following Lipinski's Rule of Five, 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)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-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide?
The CAS number of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide is 894576-34-2.
What is the molecular formula of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide?
The molecular formula of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide is C17H17Cl2N3O2S.
What is the molecular weight of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide?
The molecular weight of 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide is 397.04 g/mol.
Where can I buy 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide?
You can request a quote for 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide 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)propionyl)-4-(4-methylphenyl)thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(2,4-Dichlorophenoxy)propionyl)-4-(4-methylphenyl)thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.