AO-022/42032088
TL;DR: AO-022/42032088 (CAS 650592-91-9) is a chemical compound with molecular formula C27H20N2O2S2 and molecular weight 468.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,7,12-trimethyl-4-(2-phenylphenyl)-3-sulfanylidene-5-thia-4,8-diazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),11,13-tetraene-9,10-dione
Also Known As: AO-022/42032088, 9-(biphenyl-2-yl)-3,7,7-trimethyl-10-thioxo-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione, 7,7,12-Trimethyl-4-(2-phenylphenyl)-3-sulfanylidene-5-thia-4,8-diazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),11,13-tetraene-9,10-dione, 9-biphenyl-2-yl-3,7,7-trimethyl-10-thioxo-9,10-dihydro-7H-isothiazolo[5,4-c]pyrrolo[3,2,1-ij]quinoline-4,5-dione, 9-([1,1'-biphenyl]-2-yl)-3,7,7-trimethyl-10-thioxo-9,10-dihydro-4H-isothiazolo[5,4-c]pyrrolo[3,2,1-ij]quinoline-4,5(7H)-dione
| Molecular Formula | C27H20N2O2S2 |
|---|---|
| Molecular Weight | 468.10 g/mol |
| LogP | 6.68871 |
| Topological Polar Surface Area | 42.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 468.09662 |
| Heavy Atoms | 33 |
| Complexity | 1560.985 |
Chemical Identifiers
| CAS Number | 650592-91-9 |
|---|---|
| SMILES | CC1=C2C3=C(C=C1)C4=C(C(N3C(=O)C2=O)(C)C)SN(C4=S)C5=CC=CC=C5C6=CC=CC=C6 |
Product Overview
AO-022/42032088 (CAS 650592-91-9), with molecular formula C27H20N2O2S2 and molecular weight 468.10 g/mol. IUPAC: 7,7,12-trimethyl-4-(2-phenylphenyl)-3-sulfanylidene-5-thia-4,8-diazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),11,13-tetraene-9,10-dione.
Chemical Property Profile of AO-022/42032088
Property Insights of AO-022/42032088
The XLogP value of 6.68871 indicates that AO-022/42032088 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.31 Ų, AO-022/42032088 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/42032088 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/42032088?
The CAS number of AO-022/42032088 is 650592-91-9.
What is the molecular formula of AO-022/42032088?
The molecular formula of AO-022/42032088 is C27H20N2O2S2.
What is the molecular weight of AO-022/42032088?
The molecular weight of AO-022/42032088 is 468.10 g/mol.
Where can I buy AO-022/42032088?
You can request a quote for AO-022/42032088 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42032088?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42032088 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.