AO-022/43453534
TL;DR: AO-022/43453534 (CAS 847269-57-2) is a chemical compound with molecular formula C19H23N3O2S2 and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(2,2-dimethoxyethylsulfanyl)-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Also Known As: AO-022/43453534, 7-((2,2-dimethoxyethyl)thio)-4-isopropyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 12-(2,2-Dimethoxyethylsulfanyl)-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene, 7-[(2,2-dimethoxyethyl)sulfanyl]-4-isopropyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 7-[(2,2-dimethoxyethyl)sulfanyl]-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C19H23N3O2S2 |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 4.5626 |
| Topological Polar Surface Area | 57.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.12317 |
| Heavy Atoms | 26 |
| Complexity | 950.998 |
Chemical Identifiers
| CAS Number | 847269-57-2 |
|---|---|
| SMILES | CC(C)C1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC(OC)OC |
Product Overview
AO-022/43453534 (CAS 847269-57-2), with molecular formula C19H23N3O2S2 and molecular weight 389.12 g/mol. IUPAC: 12-(2,2-dimethoxyethylsulfanyl)-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene.
Chemical Property Profile of AO-022/43453534
Property Insights of AO-022/43453534
The XLogP value of 4.5626 indicates that AO-022/43453534 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.13 Ų, AO-022/43453534 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43453534 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 AO-022/43453534?
The CAS number of AO-022/43453534 is 847269-57-2.
What is the molecular formula of AO-022/43453534?
The molecular formula of AO-022/43453534 is C19H23N3O2S2.
What is the molecular weight of AO-022/43453534?
The molecular weight of AO-022/43453534 is 389.12 g/mol.
Where can I buy AO-022/43453534?
You can request a quote for AO-022/43453534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453534?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.