AO-022/43455380
TL;DR: AO-022/43455380 (CAS 899383-92-7) is a chemical compound with molecular formula C20H20N6O2S and molecular weight 408.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,14,14-trimethyl-N-(pyridin-3-ylmethyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
Also Known As: AO-022/43455380, 5,10,10-trimethyl-N-(pyridin-3-ylmethyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide, 5,10,10-trimethyl-N-(3-pyridinylmethyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide, 7,14,14-Trimethyl-N-(pyridin-3-ylmethyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
| Molecular Formula | C20H20N6O2S |
|---|---|
| Molecular Weight | 408.14 g/mol |
| LogP | 2.82372 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.13684 |
| Heavy Atoms | 29 |
| Complexity | 1244.564 |
Chemical Identifiers
| CAS Number | 899383-92-7 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NC(=NN14)C(=O)NCC5=CN=CC=C5 |
Product Overview
AO-022/43455380 (CAS 899383-92-7), with molecular formula C20H20N6O2S and molecular weight 408.14 g/mol. IUPAC: 7,14,14-trimethyl-N-(pyridin-3-ylmethyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide.
Chemical Property Profile of AO-022/43455380
Property Insights of AO-022/43455380
The XLogP value of 2.82372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43455380. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43455380. Following Lipinski's Rule of Five, AO-022/43455380 has 1 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-022/43455380?
The CAS number of AO-022/43455380 is 899383-92-7.
What is the molecular formula of AO-022/43455380?
The molecular formula of AO-022/43455380 is C20H20N6O2S.
What is the molecular weight of AO-022/43455380?
The molecular weight of AO-022/43455380 is 408.14 g/mol.
Where can I buy AO-022/43455380?
You can request a quote for AO-022/43455380 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43455380?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43455380 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.