3-nitroso-2-phenyl-1H-indole
TL;DR: 3-nitroso-2-phenyl-1H-indole (CAS 4676-99-7) is a chemical compound with molecular formula C14H10N2O and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitroso-2-phenyl-1H-indole
Also Known As: 3-nitroso-2-phenyl-1H-indole, 3-Nitroso-2-phenylindol, 3-Nitroso-2-Phenyindole, 3-nitroso-2-phenylindole, 2-phenylindol-3-one oxime
| Molecular Formula | C14H10N2O |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.07932 |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 4676-99-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)N=O |
| InChIKey | OKRIMXDIYQGPBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-nitroso-2-phenyl-1H-indole (CAS 4676-99-7), with molecular formula C14H10N2O and molecular weight 222.08 g/mol. IUPAC: 3-nitroso-2-phenyl-1H-indole.
Chemical Property Profile of 3-nitroso-2-phenyl-1H-indole
Property Insights of 3-nitroso-2-phenyl-1H-indole
The XLogP value of 3.1 indicates that 3-nitroso-2-phenyl-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, 3-nitroso-2-phenyl-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-nitroso-2-phenyl-1H-indole has 1 hydrogen bond donor(s) and 2 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 3-nitroso-2-phenyl-1H-indole?
The CAS number of 3-nitroso-2-phenyl-1H-indole is 4676-99-7.
What is the molecular formula of 3-nitroso-2-phenyl-1H-indole?
The molecular formula of 3-nitroso-2-phenyl-1H-indole is C14H10N2O.
What is the molecular weight of 3-nitroso-2-phenyl-1H-indole?
The molecular weight of 3-nitroso-2-phenyl-1H-indole is 222.08 g/mol.
Where can I buy 3-nitroso-2-phenyl-1H-indole?
You can request a quote for 3-nitroso-2-phenyl-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitroso-2-phenyl-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-nitroso-2-phenyl-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.