TL;DR: AO-022/43455015 (CAS 844853-14-1) is a chemical compound with molecular formula C24H23N5O3 and molecular weight 429.18008 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-butan-2-yl-17-(3,5-dimethoxyphenyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one
Also Known As: AO-022/43455015, 3-(sec-butyl)-11-(3,5-dimethoxyphenyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one, 13-Butan-2-yl-17-(3,5-dimethoxyphenyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one, 3-sec-butyl-11-(3,5-dimethoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 3-(butan-2-yl)-11-(3,5-dimethoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
| Molecular Formula | C24H23N5O3 |
| Molecular Weight | 429.18008 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.18008 Da |
| Heavy Atoms | 32 |
| Complexity | 708.0 |
| SMILES | CCC(C)N1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC(=C5)OC)OC |
| InChIKey | PCQRFWWYOLXKHU-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that AO-022/43455015 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43455015. Following Lipinski's Rule of Five, AO-022/43455015 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AO-022/43455015 is 844853-14-1.
The molecular formula of AO-022/43455015 is C24H23N5O3.
The molecular weight of AO-022/43455015 is 429.18008 g/mol.
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