AB00679218-01
TL;DR: AB00679218-01 (CAS 869636-40-8) is a chemical compound with molecular formula C12H11N3O6S and molecular weight 325.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
Also Known As: AB00679218-01, F2526-0021, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-6-oxo-1,6-dihydropyrimidine-5-sulfonamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
| Molecular Formula | C12H11N3O6S |
|---|---|
| Molecular Weight | 325.04 g/mol |
| LogP | -0.3648 |
| Topological Polar Surface Area | 130.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.03687 |
| Heavy Atoms | 22 |
| Complexity | 930.36316 |
Chemical Identifiers
| CAS Number | 869636-40-8 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CNC(=O)NC3=O |
Product Overview
AB00679218-01 (CAS 869636-40-8), with molecular formula C12H11N3O6S and molecular weight 325.04 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide.
Chemical Property Profile of AB00679218-01
Property Insights of AB00679218-01
The XLogP value of -0.3648 indicates that AB00679218-01 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.35 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00679218-01. Following Lipinski's Rule of Five, AB00679218-01 has 3 hydrogen bond donor(s) and 6 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 AB00679218-01?
The CAS number of AB00679218-01 is 869636-40-8.
What is the molecular formula of AB00679218-01?
The molecular formula of AB00679218-01 is C12H11N3O6S.
What is the molecular weight of AB00679218-01?
The molecular weight of AB00679218-01 is 325.04 g/mol.
Where can I buy AB00679218-01?
You can request a quote for AB00679218-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00679218-01?
Yes, KEHONG BIO provides custom synthesis services for AB00679218-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.