AO-022/43453602
TL;DR: AO-022/43453602 (CAS 847159-67-5) is a chemical compound with molecular formula C18H21N5O2 and molecular weight 339.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-7,11-dimethyl-N-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AO-022/43453602, 2-imino-1,10-dimethyl-N-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 2-imino-N-isobutyl-1,10-dimethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 2-imino-N-isobutyl-1,10-dimethyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C18H21N5O2 |
|---|---|
| Molecular Weight | 339.17 g/mol |
| LogP | 1.35989 |
| Topological Polar Surface Area | 92.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.16953 |
| Heavy Atoms | 25 |
| Complexity | 1108.3258 |
Chemical Identifiers
| CAS Number | 847159-67-5 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3C)C(=O)NCC(C)C |
Product Overview
AO-022/43453602 (CAS 847159-67-5), with molecular formula C18H21N5O2 and molecular weight 339.17 g/mol. IUPAC: 6-imino-7,11-dimethyl-N-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AO-022/43453602
Property Insights of AO-022/43453602
The XLogP value of 1.35989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43453602. The TPSA of 92.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453602. Following Lipinski's Rule of Five, AO-022/43453602 has 2 hydrogen bond donor(s) and 4 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-022/43453602?
The CAS number of AO-022/43453602 is 847159-67-5.
What is the molecular formula of AO-022/43453602?
The molecular formula of AO-022/43453602 is C18H21N5O2.
What is the molecular weight of AO-022/43453602?
The molecular weight of AO-022/43453602 is 339.17 g/mol.
Where can I buy AO-022/43453602?
You can request a quote for AO-022/43453602 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453602?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.