N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid
TL;DR: N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid (CAS 57679-45-5) is a chemical compound with molecular formula C9H12N4O2 and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbamoyl-1-methyl-3-(2-methyl-3-pyridinyl)urea
Also Known As: 1,3-Dimethyl-5-(3-pyridyl)biuret, N,2-Dimethyl-N'-3-pyridinylimidodicarbonic diamide, Imidodicarbonic diamide, N,2-dimethyl-N'-3-pyridinyl-, n-methyl-n-(2-methylpyridin-3-yl)dicarbonimidic diamide, 1-carbamoyl-1-methyl-3-(2-methylpyridin-3-yl)urea
| Molecular Formula | C9H12N4O2 |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.09602 |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 57679-45-5 |
|---|---|
| SMILES | CC1=C(C=CC=N1)NC(=O)N(C)C(=O)N |
| InChIKey | VRJZWBJQYZIRIN-UHFFFAOYSA-N |
Product Overview
N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid (CAS 57679-45-5), with molecular formula C9H12N4O2 and molecular weight 208.10 g/mol. IUPAC: 1-carbamoyl-1-methyl-3-(2-methyl-3-pyridinyl)urea.
Chemical Property Profile of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid
Property Insights of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid. Following Lipinski's Rule of Five, N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid has 2 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 N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid?
The CAS number of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid is 57679-45-5.
What is the molecular formula of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid?
The molecular formula of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid is C9H12N4O2.
What is the molecular weight of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid?
The molecular weight of N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid is 208.10 g/mol.
Where can I buy N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid?
You can request a quote for N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-N-(2-methylpyridin-3-yl)triimidodicarbonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.