3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide
TL;DR: 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide (CAS 130111-88-5) is a chemical compound with molecular formula C17H20N6OS and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-C-[4-(dimethylamino)phenyl]-N-(4-methoxyanilino)carbonimidoyl]iminothiourea
Also Known As: 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide, 5-Formazancarbothioamide, 3-(4-(dimethylamino)phenyl)-1-(4-methoxyphenyl)-, BRN 4269862
| Molecular Formula | C17H20N6OS |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 3.2307 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.14194 |
| Heavy Atoms | 25 |
| Complexity | 768.73 |
Chemical Identifiers
| CAS Number | 130111-88-5 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C(=N/NC2=CC=C(C=C2)OC)/N=NC(=S)N |
Product Overview
3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide (CAS 130111-88-5), with molecular formula C17H20N6OS and molecular weight 356.14 g/mol. IUPAC: [(Z)-C-[4-(dimethylamino)phenyl]-N-(4-methoxyanilino)carbonimidoyl]iminothiourea.
Chemical Property Profile of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide
Property Insights of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide
The XLogP value of 3.2307 indicates that 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide. Following Lipinski's Rule of Five, 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide has 2 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 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide?
The CAS number of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide is 130111-88-5.
What is the molecular formula of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide?
The molecular formula of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide is C17H20N6OS.
What is the molecular weight of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide?
The molecular weight of 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide is 356.14 g/mol.
Where can I buy 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide?
You can request a quote for 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-(Dimethylamino)phenyl)-1-(4-methoxyphenyl)-5-formazancarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.