Einecs 238-328-3
TL;DR: Einecs 238-328-3 (CAS 14358-89-5) is a chemical compound with molecular formula C13H21N5O7 and molecular weight 359.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-2-(hydroxymethyl)propane-1,3-diol;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
Also Known As: EINECS 238-328-3, 1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid,compound with 2-amino-2-(hydroxymethyl)propane-1,3-diol (1:1), (1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid--2-amino-2-(hydroxymethyl)propane-1,3-diol (1/1), 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid, compound with 2-amino-2-(hydroxymethyl)propane-1,3-diol (1:1), 2-amino-2-(hydroxymethyl)propane-1,3-diol; 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
| Molecular Formula | C13H21N5O7 |
|---|---|
| Molecular Weight | 359.14 g/mol |
| LogP | -3.8209 |
| Topological Polar Surface Area | 185.83 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.1441 |
| Heavy Atoms | 25 |
| Complexity | 853.73596 |
Chemical Identifiers
| CAS Number | 14358-89-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.C(C(CO)(CO)N)O |
Product Overview
Einecs 238-328-3 (CAS 14358-89-5), with molecular formula C13H21N5O7 and molecular weight 359.14 g/mol. IUPAC: 2-amino-2-(hydroxymethyl)propane-1,3-diol;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid.
Chemical Property Profile of Einecs 238-328-3
Property Insights of Einecs 238-328-3
The XLogP value of -3.8209 indicates that Einecs 238-328-3 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 185.83 Ų indicates high polarity, suggesting Einecs 238-328-3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 238-328-3 has 5 hydrogen bond donor(s) and 8 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 Einecs 238-328-3?
The CAS number of Einecs 238-328-3 is 14358-89-5.
What is the molecular formula of Einecs 238-328-3?
The molecular formula of Einecs 238-328-3 is C13H21N5O7.
What is the molecular weight of Einecs 238-328-3?
The molecular weight of Einecs 238-328-3 is 359.14 g/mol.
Where can I buy Einecs 238-328-3?
You can request a quote for Einecs 238-328-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 238-328-3?
Yes, KEHONG BIO provides custom synthesis services for Einecs 238-328-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.