Atibeprone
TL;DR: Atibeprone (CAS 153420-96-3) is a chemical compound with molecular formula C17H18N2O3S and molecular weight 330.10382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dimethyl-7-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)methoxy]chromen-2-one
Also Known As: Atibeprone, Atibeprona, Atibeprone [INN], 3,4-dimethyl-7-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)methoxy]chromen-2-one, J1.099.160I
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H18N2O3S |
| Molecular Weight | 330.10382 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.10382 Da |
| Heavy Atoms | 23 |
| Complexity | 494.0 |
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=NN=C(S3)C(C)C)C |
| InChIKey | HQTNJPCZUQAYAB-UHFFFAOYSA-N |
Chemical Property Profile of Atibeprone
Property Insights of Atibeprone
The XLogP value of 3.3 indicates that Atibeprone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Atibeprone. Following Lipinski's Rule of Five, Atibeprone has 0 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 Atibeprone?
The CAS number of Atibeprone is 153420-96-3.
What is the molecular formula of Atibeprone?
The molecular formula of Atibeprone is C17H18N2O3S.
What is the molecular weight of Atibeprone?
The molecular weight of Atibeprone is 330.10382 g/mol.
Where can I buy Atibeprone?
You can request a quote for Atibeprone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Atibeprone?
Yes, CoreyChem provides custom synthesis services for Atibeprone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.