AO-022/43453385
TL;DR: AO-022/43453385 (CAS 898056-91-2) is a chemical compound with molecular formula C27H23N5O3S and molecular weight 497.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethoxyphenyl)-2-[(4-naphthalen-1-yl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: AO-022/43453385, A3918/0166700, N-(2,5-dimethoxyphenyl)-2-[(4-naphthalen-1-yl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2,5-dimethoxyphenyl)-2-{[4-(1-naphthyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2,5-dimethoxyphenyl)-2-((4-(naphthalen-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C27H23N5O3S |
|---|---|
| Molecular Weight | 497.15 g/mol |
| LogP | 5.2305 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 497.15216 |
| Heavy Atoms | 36 |
| Complexity | 1515.695 |
Chemical Identifiers
| CAS Number | 898056-91-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2C3=CC=CC4=CC=CC=C43)C5=CC=NC=C5 |
Product Overview
AO-022/43453385 (CAS 898056-91-2), with molecular formula C27H23N5O3S and molecular weight 497.15 g/mol. IUPAC: N-(2,5-dimethoxyphenyl)-2-[(4-naphthalen-1-yl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AO-022/43453385
Property Insights of AO-022/43453385
The XLogP value of 5.2305 indicates that AO-022/43453385 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453385. Following Lipinski's Rule of Five, AO-022/43453385 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/43453385?
The CAS number of AO-022/43453385 is 898056-91-2.
What is the molecular formula of AO-022/43453385?
The molecular formula of AO-022/43453385 is C27H23N5O3S.
What is the molecular weight of AO-022/43453385?
The molecular weight of AO-022/43453385 is 497.15 g/mol.
Where can I buy AO-022/43453385?
You can request a quote for AO-022/43453385 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453385?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453385 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.