Orbofiban acetate anhydrous
TL;DR: Orbofiban acetate anhydrous (CAS 163250-91-7) is a chemical compound with molecular formula C19H27N5O6 and molecular weight 421.19614 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
acetic acid;ethyl 3-[[(3S)-1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]carbamoylamino]propanoate
Also Known As: Orbofiban acetate, Orbofiban (acetate), Orbofiban acetate anhydrous, SC 57099B, ORBOFIBAN ACETATE [WHO-DD]
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H27N5O6 |
| Molecular Weight | 421.19614 g/mol |
| XLogP | 0.41927 |
| Topological Polar Surface Area (TPSA) | 175.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.19614 Da |
| Heavy Atoms | 30 |
| Complexity | 576.0 |
| SMILES | CCOC(=O)CCNC(=O)N[C@H]1CCN(C1=O)C2=CC=C(C=C2)C(=N)N.CC(=O)O |
| InChIKey | PKHRWVBUJHJCLV-ZOWNYOTGSA-N |
Chemical Property Profile of Orbofiban acetate anhydrous
Property Insights of Orbofiban acetate anhydrous
The XLogP value of 0.41927 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Orbofiban acetate anhydrous. The TPSA of 175.0 Ų indicates high polarity, suggesting Orbofiban acetate anhydrous may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Orbofiban acetate anhydrous has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Orbofiban acetate anhydrous?
The CAS number of Orbofiban acetate anhydrous is 163250-91-7.
What is the molecular formula of Orbofiban acetate anhydrous?
The molecular formula of Orbofiban acetate anhydrous is C19H27N5O6.
What is the molecular weight of Orbofiban acetate anhydrous?
The molecular weight of Orbofiban acetate anhydrous is 421.19614 g/mol.
Where can I buy Orbofiban acetate anhydrous?
You can request a quote for Orbofiban acetate anhydrous directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Orbofiban acetate anhydrous?
Yes, CoreyChem provides custom synthesis services for Orbofiban acetate anhydrous and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.