AB01286870-01
TL;DR: AB01286870-01 (CAS 498568-27-7) is a chemical compound with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-2-pyridinyl]sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide
Also Known As: AB01286870-01, 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(3,4-dimethoxyphenyl)methyl]acetamide, 2-{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-(3,4-dimethoxybenzyl)acetamide, AM-807/13616789, 2-((6-(benzo[d][1,3]dioxol-5-yl)-3-cyanopyridin-2-yl)thio)-N-(3,4-dimethoxybenzyl)acetamide
| Molecular Formula | C24H21N3O5S |
|---|---|
| Molecular Weight | 463.12 g/mol |
| LogP | 3.77468 |
| Topological Polar Surface Area | 102.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.12018 |
| Heavy Atoms | 33 |
| Complexity | 1225.2069 |
Chemical Identifiers
| CAS Number | 498568-27-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC(=O)CSC2=C(C=CC(=N2)C3=CC4=C(C=C3)OCO4)C#N)OC |
Product Overview
AB01286870-01 (CAS 498568-27-7), with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol. IUPAC: 2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-2-pyridinyl]sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide.
Chemical Property Profile of AB01286870-01
Property Insights of AB01286870-01
The XLogP value of 3.77468 indicates that AB01286870-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01286870-01. Following Lipinski's Rule of Five, AB01286870-01 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 AB01286870-01?
The CAS number of AB01286870-01 is 498568-27-7.
What is the molecular formula of AB01286870-01?
The molecular formula of AB01286870-01 is C24H21N3O5S.
What is the molecular weight of AB01286870-01?
The molecular weight of AB01286870-01 is 463.12 g/mol.
Where can I buy AB01286870-01?
You can request a quote for AB01286870-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01286870-01?
Yes, KEHONG BIO provides custom synthesis services for AB01286870-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.