PD 131628
TL;DR: PD 131628 (CAS 127967-03-7) is a chemical compound with molecular formula C16H17FN4O3 and molecular weight 332.12848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
Also Known As: PD 131628, CI-990 (Hydrochloride), KST-1B0147, CI 990, 7-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H17FN4O3 |
| Molecular Weight | 332.12848 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 99.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.12848 Da |
| Heavy Atoms | 24 |
| Complexity | 594.0 |
| SMILES | C1CN(C[C@H]1N)C2=C(C=C3C(=O)C(=CN(C3=N2)C4CC4)C(=O)O)F |
| InChIKey | MUKSDTOOLRNSIO-QMMMGPOBSA-N |
Chemical Property Profile of PD 131628
Property Insights of PD 131628
The XLogP value of -0.1 indicates that PD 131628 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.8 Ų falls within the moderate polarity range, balancing permeability and solubility for PD 131628. Following Lipinski's Rule of Five, PD 131628 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of PD 131628?
The CAS number of PD 131628 is 127967-03-7.
What is the molecular formula of PD 131628?
The molecular formula of PD 131628 is C16H17FN4O3.
What is the molecular weight of PD 131628?
The molecular weight of PD 131628 is 332.12848 g/mol.
Where can I buy PD 131628?
You can request a quote for PD 131628 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PD 131628?
Yes, CoreyChem provides custom synthesis services for PD 131628 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.