Cephalandole A
TL;DR: Cephalandole A (CAS 5543-37-3) is a chemical compound with molecular formula C16H10N2O2 and molecular weight 262.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-indol-3-yl)-1,4-benzoxazin-2-one
Also Known As: Cephalandole A, 3-Indol-3-yl-2H-1,4-benzoxazin-2-one, 2H-1,4-BENZOXAZIN-2-ONE, 3-INDOL-3-YL-, 3-(1H-Indol-3-yl)-2H-1,4-benzoxazin-2-one, 3-(1H-Indol-3-yl)-2H-benzo[b][1,4]oxazin-2-one
| Molecular Formula | C16H10N2O2 |
|---|---|
| Molecular Weight | 262.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 262.07422 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 5543-37-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C3=NC4=CC=CC=C4OC3=O |
| InChIKey | JAURZMWTUPUGQM-UHFFFAOYSA-N |
Product Overview
Cephalandole A (CAS 5543-37-3), with molecular formula C16H10N2O2 and molecular weight 262.07 g/mol. IUPAC: 3-(1H-indol-3-yl)-1,4-benzoxazin-2-one.
Chemical Property Profile of Cephalandole A
Property Insights of Cephalandole A
The XLogP value of 3.1 indicates that Cephalandole A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, Cephalandole A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cephalandole A 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 Cephalandole A?
The CAS number of Cephalandole A is 5543-37-3.
What is the molecular formula of Cephalandole A?
The molecular formula of Cephalandole A is C16H10N2O2.
What is the molecular weight of Cephalandole A?
The molecular weight of Cephalandole A is 262.07 g/mol.
Where can I buy Cephalandole A?
You can request a quote for Cephalandole A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cephalandole A?
Yes, KEHONG BIO provides custom synthesis services for Cephalandole A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.