N-(2-Methylphenyl)triimidodicarbonic acid
TL;DR: N-(2-Methylphenyl)triimidodicarbonic acid (CAS 29540-83-8) is a chemical compound with molecular formula C9H11N3O2 and molecular weight 193.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbamoyl-1-(2-methylphenyl)urea
Also Known As: 3-Methyl-5-phenylbiuret, 3-Methyl-1-phenyl-biuret, N-Methyl-N-anilinoformyl-harnstoff, 1-carbamoyl-1-(2-methylphenyl)urea, 2-Methyl-N-phenylimidodicarbonic diamide
| Molecular Formula | C9H11N3O2 |
|---|---|
| Molecular Weight | 193.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 89.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.08513 |
| Heavy Atoms | 14 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 29540-83-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N(C(=O)N)C(=O)N |
| InChIKey | UCKFFYHCEHUHBC-UHFFFAOYSA-N |
Product Overview
N-(2-Methylphenyl)triimidodicarbonic acid (CAS 29540-83-8), with molecular formula C9H11N3O2 and molecular weight 193.09 g/mol. IUPAC: 1-carbamoyl-1-(2-methylphenyl)urea.
Chemical Property Profile of N-(2-Methylphenyl)triimidodicarbonic acid
Property Insights of N-(2-Methylphenyl)triimidodicarbonic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methylphenyl)triimidodicarbonic acid. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Methylphenyl)triimidodicarbonic acid. Following Lipinski's Rule of Five, N-(2-Methylphenyl)triimidodicarbonic acid has 2 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 N-(2-Methylphenyl)triimidodicarbonic acid?
The CAS number of N-(2-Methylphenyl)triimidodicarbonic acid is 29540-83-8.
What is the molecular formula of N-(2-Methylphenyl)triimidodicarbonic acid?
The molecular formula of N-(2-Methylphenyl)triimidodicarbonic acid is C9H11N3O2.
What is the molecular weight of N-(2-Methylphenyl)triimidodicarbonic acid?
The molecular weight of N-(2-Methylphenyl)triimidodicarbonic acid is 193.09 g/mol.
Where can I buy N-(2-Methylphenyl)triimidodicarbonic acid?
You can request a quote for N-(2-Methylphenyl)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-(2-Methylphenyl)triimidodicarbonic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methylphenyl)triimidodicarbonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.