AJ-292/41083085
TL;DR: AJ-292/41083085 (CAS 381708-84-5) is a chemical compound with molecular formula C18H21N3OS2 and molecular weight 359.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-butylsulfanyl-5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaene
Also Known As: AJ-292/41083085, 4-(butylsulfanyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 4-(butylthio)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, butyl 8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl sulfide
| Molecular Formula | C18H21N3OS2 |
|---|---|
| Molecular Weight | 359.11 g/mol |
| LogP | 4.983 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.1126 |
| Heavy Atoms | 24 |
| Complexity | 904.04675 |
Chemical Identifiers
| CAS Number | 381708-84-5 |
|---|---|
| SMILES | CCCCSC1=NC=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C |
Product Overview
AJ-292/41083085 (CAS 381708-84-5), with molecular formula C18H21N3OS2 and molecular weight 359.11 g/mol. IUPAC: 15-butylsulfanyl-5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaene.
Chemical Property Profile of AJ-292/41083085
Property Insights of AJ-292/41083085
The XLogP value of 4.983 indicates that AJ-292/41083085 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, AJ-292/41083085 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/41083085 has 0 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 AJ-292/41083085?
The CAS number of AJ-292/41083085 is 381708-84-5.
What is the molecular formula of AJ-292/41083085?
The molecular formula of AJ-292/41083085 is C18H21N3OS2.
What is the molecular weight of AJ-292/41083085?
The molecular weight of AJ-292/41083085 is 359.11 g/mol.
Where can I buy AJ-292/41083085?
You can request a quote for AJ-292/41083085 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/41083085?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/41083085 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.