![4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide structure](/static/products/642/642945-34-4.png)
4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide
TL;DR: 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide (CAS 642945-34-4) is a chemical compound with molecular formula C16H17N3O2S2 and molecular weight 347.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide
Also Known As: AN-329/41572474, 4,5-dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide, 4,5-dimethyl-2-({[(2-methylbenzoyl)amino]carbonothioyl}amino)-3-thiophenecarboxamide, 4,5-dimethyl-2-({[(2-methylbenzoyl)amino]carbothioyl}amino)-3-thiophenecarboxamide, 4,5-dimethyl-2-({[(2-methylphenyl)carbonyl]carbamothioyl}amino)thiophene-3-carboxamide
| Molecular Formula | C16H17N3O2S2 |
|---|---|
| Molecular Weight | 347.08 g/mol |
| LogP | 2.89906 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.07623 |
| Heavy Atoms | 23 |
| Complexity | 796.61816 |
Chemical Identifiers
| CAS Number | 642945-34-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N |
Product Overview
4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide (CAS 642945-34-4), with molecular formula C16H17N3O2S2 and molecular weight 347.08 g/mol. IUPAC: 4,5-dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide.
Chemical Property Profile of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide
Property Insights of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide
The XLogP value of 2.89906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide. Following Lipinski's Rule of Five, 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide has 3 hydrogen bond donor(s) and 4 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 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide?
The CAS number of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide is 642945-34-4.
What is the molecular formula of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide?
The molecular formula of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide is C16H17N3O2S2.
What is the molecular weight of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide?
The molecular weight of 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide is 347.08 g/mol.
Where can I buy 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide?
You can request a quote for 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-2-[(2-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.