1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea
TL;DR: 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea (CAS 6178-27-4) is a chemical compound with molecular formula C8H8Cl2N4OS and molecular weight 277.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(carbamothioylamino)-3-(3,4-dichlorophenyl)urea
Also Known As: 1-(carbamothioylamino)-3-(3,4-dichlorophenyl)urea, 1-(3,4-DICHLOROPHENYL)-5-THIOBIUREA, 2-carbamothioyl-N-(3,4-dichlorophenyl)hydrazinecarboxamide, 3-(CARBAMOTHIOYLAMINO)-1-(3,4-DICHLOROPHENYL)UREA, 2-carbamothioyl-N-(3,4-dichlorophenyl)hydrazine-1-carboxamide
| Molecular Formula | C8H8Cl2N4OS |
|---|---|
| Molecular Weight | 277.98 g/mol |
| LogP | 1.8631 |
| Topological Polar Surface Area | 79.18 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.97958 |
| Heavy Atoms | 16 |
| Complexity | 426.4994 |
Chemical Identifiers
| CAS Number | 6178-27-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)NNC(=S)N)Cl)Cl |
Product Overview
1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea (CAS 6178-27-4), with molecular formula C8H8Cl2N4OS and molecular weight 277.98 g/mol. IUPAC: 1-(carbamothioylamino)-3-(3,4-dichlorophenyl)urea.
Chemical Property Profile of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea
Property Insights of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea
The XLogP value of 1.8631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea. The TPSA of 79.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea. Following Lipinski's Rule of Five, 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea has 4 hydrogen bond donor(s) and 2 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-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea?
The CAS number of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea is 6178-27-4.
What is the molecular formula of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea?
The molecular formula of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea is C8H8Cl2N4OS.
What is the molecular weight of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea?
The molecular weight of 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea is 277.98 g/mol.
Where can I buy 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea?
You can request a quote for 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Carbamothioylamino)-3-(3,4-dichlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.