Cni H1894
TL;DR: Cni H1894 (CAS 87933-49-1) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-acetyl-5-aminophenyl)ethanone
Also Known As: 3,5-Diacetylaniline, 1-(3-acetyl-5-aminophenyl)ethan-1-one, Cni H1894, 1-(3-acetyl-5-aminophenyl)ethanone, Ethanone, 1,1'-(5-amino-1,3-phenylene)bis-
| Molecular Formula | C10H11NO2 |
|---|---|
| Molecular Weight | 177.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.07898 |
| Heavy Atoms | 13 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 87933-49-1 |
|---|---|
| SMILES | CC(=O)C1=CC(=CC(=C1)N)C(=O)C |
| InChIKey | XUVYQFMQZZYSLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cni H1894 (CAS 87933-49-1), with molecular formula C10H11NO2 and molecular weight 177.08 g/mol. IUPAC: 1-(3-acetyl-5-aminophenyl)ethanone.
Chemical Property Profile of Cni H1894
Property Insights of Cni H1894
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cni H1894. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Cni H1894. Following Lipinski's Rule of Five, Cni H1894 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
Frequently Asked Questions
What is the CAS number of Cni H1894?
The CAS number of Cni H1894 is 87933-49-1.
What is the molecular formula of Cni H1894?
The molecular formula of Cni H1894 is C10H11NO2.
What is the molecular weight of Cni H1894?
The molecular weight of Cni H1894 is 177.08 g/mol.
Where can I buy Cni H1894?
You can request a quote for Cni H1894 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cni H1894?
Yes, KEHONG BIO provides custom synthesis services for Cni H1894 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.