4-Aminophenytoin
TL;DR: 4-Aminophenytoin (CAS 88168-80-3) is a chemical compound with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-aminophenyl)-5-phenylimidazolidine-2,4-dione
Also Known As: p-Aminophenytoin, 4-Aminophenytoin, 5-(4-aminophenyl)-5-phenylimidazolidine-2,4-dione, RefChem:97874
| Molecular Formula | C15H13N3O2 |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.10077 |
| Heavy Atoms | 20 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 88168-80-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=C(C=C3)N |
| InChIKey | NWQNTMVPBBAVCL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Aminophenytoin (CAS 88168-80-3), with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol. IUPAC: 5-(4-aminophenyl)-5-phenylimidazolidine-2,4-dione.
Chemical Property Profile of 4-Aminophenytoin
Property Insights of 4-Aminophenytoin
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminophenytoin. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminophenytoin. Following Lipinski's Rule of Five, 4-Aminophenytoin has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Aminophenytoin?
The CAS number of 4-Aminophenytoin is 88168-80-3.
What is the molecular formula of 4-Aminophenytoin?
The molecular formula of 4-Aminophenytoin is C15H13N3O2.
What is the molecular weight of 4-Aminophenytoin?
The molecular weight of 4-Aminophenytoin is 267.10 g/mol.
Where can I buy 4-Aminophenytoin?
You can request a quote for 4-Aminophenytoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Aminophenytoin?
Yes, KEHONG BIO provides custom synthesis services for 4-Aminophenytoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.