A-816719.1
TL;DR: A-816719.1 (CAS 162763-53-3) is a chemical compound with molecular formula C18H21ClFN3O3 and molecular weight 381.12555 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid;hydrochloride
Also Known As: ABT-719 HCl, ABT 719, ABT719, A 816719.1, A-816719.1
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H21ClFN3O3 |
| Molecular Weight | 381.12555 g/mol |
| XLogP | 2.28182 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.12555 Da |
| Heavy Atoms | 26 |
| Complexity | 804.0 |
| SMILES | CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CC[C@@H](C4)N.Cl |
| InChIKey | OMXXLAGAHWXLSP-MERQFXBCSA-N |
Chemical Property Profile of A-816719.1
Property Insights of A-816719.1
The XLogP value of 2.28182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A-816719.1. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for A-816719.1. Following Lipinski's Rule of Five, A-816719.1 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of A-816719.1?
The CAS number of A-816719.1 is 162763-53-3.
What is the molecular formula of A-816719.1?
The molecular formula of A-816719.1 is C18H21ClFN3O3.
What is the molecular weight of A-816719.1?
The molecular weight of A-816719.1 is 381.12555 g/mol.
Where can I buy A-816719.1?
You can request a quote for A-816719.1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for A-816719.1?
Yes, CoreyChem provides custom synthesis services for A-816719.1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.