N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid
TL;DR: N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid (CAS 65717-98-8) is a chemical compound with molecular formula C15H20N2O5 and molecular weight 308.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[carboxymethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetic acid
Also Known As: starbld0007437, N-(2,4,6-TRIMETHYLPHENYL-CARBAMOYL-METHYL)-IMINO-DIACETIC ACID, 2,2'-(2-(mesitylamino)-2-oxoethylazanediyl)diacetic acid, 2,2'-((2-(Mesitylamino)-2-oxoethyl)azanediyl)diacetic acid, N-(2,4,6-Trimethylphenylcarbamoylmethyl)imino-diacetic acid
| Molecular Formula | C15H20N2O5 |
|---|---|
| Molecular Weight | 308.14 g/mol |
| LogP | 1.02156 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 308.1372 |
| Heavy Atoms | 22 |
| Complexity | 558.59076 |
Chemical Identifiers
| CAS Number | 65717-98-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)CN(CC(=O)O)CC(=O)O)C |
Product Overview
N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid (CAS 65717-98-8), with molecular formula C15H20N2O5 and molecular weight 308.14 g/mol. IUPAC: 2-[carboxymethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetic acid.
Chemical Property Profile of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid
Property Insights of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid
The XLogP value of 1.02156 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid. Following Lipinski's Rule of Five, N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic 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-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid?
The CAS number of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid is 65717-98-8.
What is the molecular formula of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid?
The molecular formula of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid is C15H20N2O5.
What is the molecular weight of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid?
The molecular weight of N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid is 308.14 g/mol.
Where can I buy N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid?
You can request a quote for N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4,6-Trimethylphenyl-carbamoyl-methyl)-imino-diacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.