2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid
TL;DR: 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid (CAS 492437-16-8) is a chemical compound with molecular formula C14H23N3O8 and molecular weight 361.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-[bis(carboxymethyl)amino]-4-(carboxymethyl)-6-methyl-1,4-diazepan-1-yl]acetic acid
Also Known As: AAZTA, J2.122.506A, 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid, 6-[bis(carboxymethyl)amino]-1,4-bis(carboxymethyl)-6-methyl-1,4-diazepane, 2-[6-(bis(carboxymethyl)amino)-4-(carboxymethyl)-6-methyl-1,4-diazepan-1-yl]acetic Acid
| Molecular Formula | C14H23N3O8 |
|---|---|
| Molecular Weight | 361.15 g/mol |
| LogP | -1.9969 |
| Topological Polar Surface Area | 158.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 361.14853 |
| Heavy Atoms | 25 |
| Complexity | 496.1699 |
Chemical Identifiers
| CAS Number | 492437-16-8 |
|---|---|
| SMILES | CC1(CN(CCN(C1)CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O |
Product Overview
2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid (CAS 492437-16-8), with molecular formula C14H23N3O8 and molecular weight 361.15 g/mol. IUPAC: 2-[6-[bis(carboxymethyl)amino]-4-(carboxymethyl)-6-methyl-1,4-diazepan-1-yl]acetic acid.
Chemical Property Profile of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid
Property Insights of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid
The XLogP value of -1.9969 indicates that 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.92 Ų indicates high polarity, suggesting 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid has 4 hydrogen bond donor(s) and 7 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 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid?
The CAS number of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid is 492437-16-8.
What is the molecular formula of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid?
The molecular formula of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid is C14H23N3O8.
What is the molecular weight of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid?
The molecular weight of 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid is 361.15 g/mol.
Where can I buy 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid?
You can request a quote for 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((1,4-Bis(carboxymethyl)-6-methyl-1,4-diazepan-6-yl)azanediyl)diacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.