AO-022/42099964
TL;DR: AO-022/42099964 (CAS 614747-59-0) is a chemical compound with molecular formula C24H23N5O2 and molecular weight 413.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-11-methyl-N-[(4-methylphenyl)methyl]-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AO-022/42099964, F1425-2256, 1-allyl-2-imino-10-methyl-N-(4-methylbenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 1-allyl-2-imino-10-methyl-N-(4-methylbenzyl)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 6-imino-11-methyl-N-[(4-methylphenyl)methyl]-2-oxo-7-(prop-2-en-1-yl)-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
| Molecular Formula | C24H23N5O2 |
|---|---|
| Molecular Weight | 413.19 g/mol |
| LogP | 2.86151 |
| Topological Polar Surface Area | 92.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.18518 |
| Heavy Atoms | 31 |
| Complexity | 1445.8295 |
Chemical Identifiers
| CAS Number | 614747-59-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(N=C4C(=CC=CN4C3=O)C)N(C2=N)CC=C |
Product Overview
AO-022/42099964 (CAS 614747-59-0), with molecular formula C24H23N5O2 and molecular weight 413.19 g/mol. IUPAC: 6-imino-11-methyl-N-[(4-methylphenyl)methyl]-2-oxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AO-022/42099964
Property Insights of AO-022/42099964
The XLogP value of 2.86151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/42099964. The TPSA of 92.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42099964. Following Lipinski's Rule of Five, AO-022/42099964 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-022/42099964?
The CAS number of AO-022/42099964 is 614747-59-0.
What is the molecular formula of AO-022/42099964?
The molecular formula of AO-022/42099964 is C24H23N5O2.
What is the molecular weight of AO-022/42099964?
The molecular weight of AO-022/42099964 is 413.19 g/mol.
Where can I buy AO-022/42099964?
You can request a quote for AO-022/42099964 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42099964?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42099964 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.