AJ-292/42006073
TL;DR: AJ-292/42006073 (CAS 489396-76-1) is a chemical compound with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,13-trimethyl-15-phenylmethoxy-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-292/42006073, 1-Benzyloxy-3,8,8-trimethyl-8,9-dihydro-6H-7-oxa-11-thia-2,4,10-triaza-benzo[b]fluorene, benzyl 2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl ether, 5,5,13-trimethyl-15-phenylmethoxy-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaene, 4-(benzyloxy)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C22H21N3O2S |
|---|---|
| Molecular Weight | 391.14 g/mol |
| LogP | 4.97822 |
| Topological Polar Surface Area | 57.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.13544 |
| Heavy Atoms | 28 |
| Complexity | 1185.0549 |
Chemical Identifiers
| CAS Number | 489396-76-1 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)OCC3=CC=CC=C3)SC4=C2C=C5COC(CC5=N4)(C)C |
Product Overview
AJ-292/42006073 (CAS 489396-76-1), with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol. IUPAC: 5,5,13-trimethyl-15-phenylmethoxy-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-292/42006073
Property Insights of AJ-292/42006073
The XLogP value of 4.97822 indicates that AJ-292/42006073 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.13 Ų, AJ-292/42006073 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/42006073 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-292/42006073?
The CAS number of AJ-292/42006073 is 489396-76-1.
What is the molecular formula of AJ-292/42006073?
The molecular formula of AJ-292/42006073 is C22H21N3O2S.
What is the molecular weight of AJ-292/42006073?
The molecular weight of AJ-292/42006073 is 391.14 g/mol.
Where can I buy AJ-292/42006073?
You can request a quote for AJ-292/42006073 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/42006073?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/42006073 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.