Methyl n'-(2,6-dimethylphenyl)carbamimidothioate
TL;DR: Methyl n'-(2,6-dimethylphenyl)carbamimidothioate (CAS 33499-12-6) is a chemical compound with molecular formula C10H14N2S and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-(2,6-dimethylphenyl)carbamimidothioate
Also Known As: methyl n'-(2,6-dimethylphenyl)carbamimidothioate
| Molecular Formula | C10H14N2S |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.08777 |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 33499-12-6 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N=C(N)SC |
| InChIKey | QKBCIDGDSBVTQG-UHFFFAOYSA-N |
Product Overview
Methyl n'-(2,6-dimethylphenyl)carbamimidothioate (CAS 33499-12-6), with molecular formula C10H14N2S and molecular weight 194.09 g/mol. IUPAC: methyl N'-(2,6-dimethylphenyl)carbamimidothioate.
Chemical Property Profile of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate
Property Insights of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl n'-(2,6-dimethylphenyl)carbamimidothioate. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl n'-(2,6-dimethylphenyl)carbamimidothioate. Following Lipinski's Rule of Five, Methyl n'-(2,6-dimethylphenyl)carbamimidothioate has 1 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 Methyl n'-(2,6-dimethylphenyl)carbamimidothioate?
The CAS number of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate is 33499-12-6.
What is the molecular formula of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate?
The molecular formula of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate is C10H14N2S.
What is the molecular weight of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate?
The molecular weight of Methyl n'-(2,6-dimethylphenyl)carbamimidothioate is 194.09 g/mol.
Where can I buy Methyl n'-(2,6-dimethylphenyl)carbamimidothioate?
You can request a quote for Methyl n'-(2,6-dimethylphenyl)carbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl n'-(2,6-dimethylphenyl)carbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for Methyl n'-(2,6-dimethylphenyl)carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.