A3753/0159108
TL;DR: A3753/0159108 (CAS 727671-56-9) is a chemical compound with molecular formula C27H28N4O2S2 and molecular weight 504.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: A3753/0159108, 1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone, 1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone, 1-[6-METHOXY-2,2,4-TRIMETHYL-3,4-DIHYDRO-1(2H)-QUINOLINYL]-2-{[4-PHENYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-1-ETHANONE, 6-methoxy-2,2,4-trimethyl-1-({[4-phenyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio}acetyl)-1,2,3,4-tetrahydroquinoline
| Molecular Formula | C27H28N4O2S2 |
|---|---|
| Molecular Weight | 504.17 g/mol |
| LogP | 6.4155 |
| Topological Polar Surface Area | 60.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.16537 |
| Heavy Atoms | 35 |
| Complexity | 1332.7374 |
Chemical Identifiers
| CAS Number | 727671-56-9 |
|---|---|
| SMILES | CC1CC(N(C2=C1C=C(C=C2)OC)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CS5)(C)C |
Product Overview
A3753/0159108 (CAS 727671-56-9), with molecular formula C27H28N4O2S2 and molecular weight 504.17 g/mol. IUPAC: 1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of A3753/0159108
Property Insights of A3753/0159108
The XLogP value of 6.4155 indicates that A3753/0159108 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A3753/0159108. Following Lipinski's Rule of Five, A3753/0159108 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3753/0159108?
The CAS number of A3753/0159108 is 727671-56-9.
What is the molecular formula of A3753/0159108?
The molecular formula of A3753/0159108 is C27H28N4O2S2.
What is the molecular weight of A3753/0159108?
The molecular weight of A3753/0159108 is 504.17 g/mol.
Where can I buy A3753/0159108?
You can request a quote for A3753/0159108 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3753/0159108?
Yes, KEHONG BIO provides custom synthesis services for A3753/0159108 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.