AJ-292/37013006
TL;DR: AJ-292/37013006 (CAS 370071-92-4) is a chemical compound with molecular formula C18H18N6S2 and molecular weight 382.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-7-ethylsulfanyl-10-thia-3,4,5,6,8,13-hexazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: AJ-292/37013006, 9-benzyl-5-(ethylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-c]pyrimidine, 9-benzyl-5-(ethylthio)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-c]pyrimidine, 9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetraazolo[1,5-c]pyrimidin-5-yl ethyl sulfide
| Molecular Formula | C18H18N6S2 |
|---|---|
| Molecular Weight | 382.10 g/mol |
| LogP | 3.4043 |
| Topological Polar Surface Area | 59.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.10342 |
| Heavy Atoms | 26 |
| Complexity | 1071.6178 |
Chemical Identifiers
| CAS Number | 370071-92-4 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C5=NN=NN51 |
Product Overview
AJ-292/37013006 (CAS 370071-92-4), with molecular formula C18H18N6S2 and molecular weight 382.10 g/mol. IUPAC: 13-benzyl-7-ethylsulfanyl-10-thia-3,4,5,6,8,13-hexazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
Chemical Property Profile of AJ-292/37013006
Property Insights of AJ-292/37013006
The XLogP value of 3.4043 indicates that AJ-292/37013006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.21 Ų, AJ-292/37013006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/37013006 has 0 hydrogen bond donor(s) and 7 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-292/37013006?
The CAS number of AJ-292/37013006 is 370071-92-4.
What is the molecular formula of AJ-292/37013006?
The molecular formula of AJ-292/37013006 is C18H18N6S2.
What is the molecular weight of AJ-292/37013006?
The molecular weight of AJ-292/37013006 is 382.10 g/mol.
Where can I buy AJ-292/37013006?
You can request a quote for AJ-292/37013006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/37013006?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/37013006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.