N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid
TL;DR: N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid (CAS 68656-61-1) is a chemical compound with molecular formula C11H15N5O3 and molecular weight 265.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethyl-4-nitrophenyl)-3-(N'-methylcarbamimidoyl)urea
Also Known As: Urea, 1-(2,6-dimethyl-4-nitrophenyl)-3-methylamidino-, N-(2,6-Dimethyl-4-nitrophenyl)-N'-(imino(methylamino)methyl)-urea, Urea, N-(2,6-dimethyl-4-nitrophenyl)-N'-(imino(methylamino)methyl)-, 1-(2,6-dimethyl-4-nitrophenyl)-3-(N'-methylcarbamimidoyl)urea, 1-(2,6-dimethyl-4-nitrophenyl)-3-(N-methylcarbamimidoyl)urea
| Molecular Formula | C11H15N5O3 |
|---|---|
| Molecular Weight | 265.12 g/mol |
| LogP | 1.27764 |
| Topological Polar Surface Area | 122.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.1175 |
| Heavy Atoms | 19 |
| Complexity | 530.2568 |
Chemical Identifiers
| CAS Number | 68656-61-1 |
|---|---|
| SMILES | CC1=CC(=CC(=C1NC(=O)NC(=NC)N)C)[N+](=O)[O-] |
Product Overview
N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid (CAS 68656-61-1), with molecular formula C11H15N5O3 and molecular weight 265.12 g/mol. IUPAC: 1-(2,6-dimethyl-4-nitrophenyl)-3-(N'-methylcarbamimidoyl)urea.
Chemical Property Profile of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid
Property Insights of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid
The XLogP value of 1.27764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid. The TPSA of 122.65 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid. Following Lipinski's Rule of Five, N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid 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 N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid?
The CAS number of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid is 68656-61-1.
What is the molecular formula of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid?
The molecular formula of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid is C11H15N5O3.
What is the molecular weight of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid?
The molecular weight of N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid is 265.12 g/mol.
Where can I buy N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid?
You can request a quote for N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2,6-Dimethyl-4-nitrophenyl)-N'-(N-methylcarbamimidoyl)carbamimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.