Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate
TL;DR: Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate (CAS 65009-22-5) is a chemical compound with molecular formula C12H19N5O4 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylphenyl)-1-methyl-3-(N'-methylcarbamimidoyl)urea;nitric acid
Also Known As: Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate, Urea, N-(2,6-dimethylphenyl)-N'-(imino(methylamino)methyl)-N-methyl-, mononitrate, N-(2,6-Dimethylphenyl)-N'-(imino(methylamino)methyl)-N-methyl-urea nitrate, 1-(2',6'-dimethylphenyl)-1-methyl-3-methylamidinourea nitrate, 1-(2,6-dimethylphenyl)-1-methyl-3-(N'-methylcarbamimidoyl)urea,nitric acid
| Molecular Formula | C12H19N5O4 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 1.04604 |
| Topological Polar Surface Area | 134.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.1437 |
| Heavy Atoms | 21 |
| Complexity | 520.19934 |
Chemical Identifiers
| CAS Number | 65009-22-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N(C)C(=O)NC(=NC)N.[N+](=O)(O)[O-] |
Product Overview
Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate (CAS 65009-22-5), with molecular formula C12H19N5O4 and molecular weight 297.14 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-1-methyl-3-(N'-methylcarbamimidoyl)urea;nitric acid.
Chemical Property Profile of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate
Property Insights of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate
The XLogP value of 1.04604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate. The TPSA of 134.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate. Following Lipinski's Rule of Five, Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate 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 Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate?
The CAS number of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate is 65009-22-5.
What is the molecular formula of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate?
The molecular formula of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate is C12H19N5O4.
What is the molecular weight of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate?
The molecular weight of Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate is 297.14 g/mol.
Where can I buy Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate?
You can request a quote for Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-methyl-3-methylamidino-1-(2,6-xylyl)-, nitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.