TL;DR: AQ-RA 721 (CAS 139051-89-1) is a chemical compound with molecular formula C22H23N3O2 and molecular weight 361.17902 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-oxo-5,11-dihydrobenzo[c][1]benzazepine-11-carboxamide
Also Known As: Aqra 721, AQ-RA 721, AQ-RA-721, N-(1-azabicyclo[2.2.2]octan-3-yl)-6-oxo-5,11-dihydrobenzo[c][1]benzazepine-11-carboxamide, 5H-Dibenz(b,e)azepine-11-carboxamide, N-1-azabicyclo(2.2.2)oct-3-yl-6,11-dihydro-6-oxo-
| Molecular Formula | C22H23N3O2 |
| Molecular Weight | 361.17902 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.17902 Da |
| Heavy Atoms | 27 |
| Complexity | 586.0 |
| SMILES | C1CN2CCC1C(C2)NC(=O)C3C4=CC=CC=C4C(=O)NC5=CC=CC=C35 |
| InChIKey | UDOYPNBXGCVNFY-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AQ-RA 721. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-RA 721. Following Lipinski's Rule of Five, AQ-RA 721 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AQ-RA 721 is 139051-89-1.
The molecular formula of AQ-RA 721 is C22H23N3O2.
The molecular weight of AQ-RA 721 is 361.17902 g/mol.
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