A3637/0154327
TL;DR: A3637/0154327 (CAS 697240-50-9) is a chemical compound with molecular formula C19H21N5O7 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-4,5-dimethoxybenzoate
Also Known As: A3637/0154327, methyl 2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]amino}-4,5-dimethoxybenzoate, methyl 2-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-4,5-dimethoxybenzoate, Methyl 4,5-dimethoxy-2-[[2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)acetyl]amino]benzoate, METHYL 2-[2-(1,3-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL)ACETAMIDO]-4,5-DIMETHOXYBENZOATE
| Molecular Formula | C19H21N5O7 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | -0.1238 |
| Topological Polar Surface Area | 135.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1441 |
| Heavy Atoms | 31 |
| Complexity | 1301.6897 |
Chemical Identifiers
| CAS Number | 697240-50-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC |
Product Overview
A3637/0154327 (CAS 697240-50-9), with molecular formula C19H21N5O7 and molecular weight 431.14 g/mol. IUPAC: methyl 2-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-4,5-dimethoxybenzoate.
Chemical Property Profile of A3637/0154327
Property Insights of A3637/0154327
The XLogP value of -0.1238 indicates that A3637/0154327 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.68 Ų falls within the moderate polarity range, balancing permeability and solubility for A3637/0154327. Following Lipinski's Rule of Five, A3637/0154327 has 1 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 A3637/0154327?
The CAS number of A3637/0154327 is 697240-50-9.
What is the molecular formula of A3637/0154327?
The molecular formula of A3637/0154327 is C19H21N5O7.
What is the molecular weight of A3637/0154327?
The molecular weight of A3637/0154327 is 431.14 g/mol.
Where can I buy A3637/0154327?
You can request a quote for A3637/0154327 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3637/0154327?
Yes, KEHONG BIO provides custom synthesis services for A3637/0154327 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.