Nafagrel
TL;DR: Nafagrel (CAS 97901-21-8) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
Also Known As: Nafagrel, Nafagrelum, Nafagrel [INN], Nafagrelum [INN-Latin], nafagrel hydrochloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H16N2O2 |
| Molecular Weight | 256.1212 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.1212 Da |
| Heavy Atoms | 19 |
| Complexity | 334.0 |
| SMILES | C1CC2=C(CC1CN3C=CN=C3)C=CC(=C2)C(=O)O |
| InChIKey | VJJHOPPXRPHVCA-UHFFFAOYSA-N |
Chemical Property Profile of Nafagrel
Property Insights of Nafagrel
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nafagrel. With a topological polar surface area (TPSA) of 55.1 Ų, Nafagrel exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nafagrel has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nafagrel?
The CAS number of Nafagrel is 97901-21-8.
What is the molecular formula of Nafagrel?
The molecular formula of Nafagrel is C15H16N2O2.
What is the molecular weight of Nafagrel?
The molecular weight of Nafagrel is 256.1212 g/mol.
Where can I buy Nafagrel?
You can request a quote for Nafagrel directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nafagrel?
Yes, CoreyChem provides custom synthesis services for Nafagrel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.