AJ-292/40675176
TL;DR: AJ-292/40675176 (CAS 375350-29-1) is a chemical compound with molecular formula C27H26N4O3S2 and molecular weight 518.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-methoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-13-methyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: AJ-292/40675176, 1-[(4-methoxybenzyl)sulfanyl]-4-(4-methoxyphenyl)-8-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 1-((4-methoxybenzyl)thio)-4-(4-methoxyphenyl)-8-methyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 7-(4-methoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-13-methyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
| Molecular Formula | C27H26N4O3S2 |
|---|---|
| Molecular Weight | 518.14 g/mol |
| LogP | 5.5292 |
| Topological Polar Surface Area | 70.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.14465 |
| Heavy Atoms | 36 |
| Complexity | 1618.1603 |
Chemical Identifiers
| CAS Number | 375350-29-1 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC |
Product Overview
AJ-292/40675176 (CAS 375350-29-1), with molecular formula C27H26N4O3S2 and molecular weight 518.14 g/mol. IUPAC: 7-(4-methoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-13-methyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
Chemical Property Profile of AJ-292/40675176
Property Insights of AJ-292/40675176
The XLogP value of 5.5292 indicates that AJ-292/40675176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.65 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/40675176. Following Lipinski's Rule of Five, AJ-292/40675176 has 0 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 AJ-292/40675176?
The CAS number of AJ-292/40675176 is 375350-29-1.
What is the molecular formula of AJ-292/40675176?
The molecular formula of AJ-292/40675176 is C27H26N4O3S2.
What is the molecular weight of AJ-292/40675176?
The molecular weight of AJ-292/40675176 is 518.14 g/mol.
Where can I buy AJ-292/40675176?
You can request a quote for AJ-292/40675176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40675176?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40675176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.