AS-871/43103217
TL;DR: AS-871/43103217 (CAS 690247-81-5) is a chemical compound with molecular formula C24H29N5O2S and molecular weight 451.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
Also Known As: AS-871/43103217, 3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide, 3-{[3-(4-methylphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-N-[2-(4-morpholinyl)ethyl]-3-phenylpropanamide, 3-[3-(4-methylphenyl)(1H-1,2,4-triazol-5-ylthio)]-N-(2-morpholin-4-ylethyl)-3- phenylpropanamide, 3-{[3-(4-methylphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-N-[2-(morpholin-4-yl)ethyl]-3-phenylpropanamide
| Molecular Formula | C24H29N5O2S |
|---|---|
| Molecular Weight | 451.20 g/mol |
| LogP | 3.45202 |
| Topological Polar Surface Area | 83.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 451.2042 |
| Heavy Atoms | 32 |
| Complexity | 987.13885 |
Chemical Identifiers
| CAS Number | 690247-81-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=NN2)SC(CC(=O)NCCN3CCOCC3)C4=CC=CC=C4 |
Product Overview
AS-871/43103217 (CAS 690247-81-5), with molecular formula C24H29N5O2S and molecular weight 451.20 g/mol. IUPAC: 3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide.
Chemical Property Profile of AS-871/43103217
Property Insights of AS-871/43103217
The XLogP value of 3.45202 indicates that AS-871/43103217 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/43103217. Following Lipinski's Rule of Five, AS-871/43103217 has 2 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 AS-871/43103217?
The CAS number of AS-871/43103217 is 690247-81-5.
What is the molecular formula of AS-871/43103217?
The molecular formula of AS-871/43103217 is C24H29N5O2S.
What is the molecular weight of AS-871/43103217?
The molecular weight of AS-871/43103217 is 451.20 g/mol.
Where can I buy AS-871/43103217?
You can request a quote for AS-871/43103217 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43103217?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43103217 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.