Methyl 2-phenylisoindole-1-carboxylate
TL;DR: Methyl 2-phenylisoindole-1-carboxylate (CAS 56365-73-2) is a chemical compound with molecular formula C16H13NO2 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-phenylisoindole-1-carboxylate
Also Known As: methyl 2-phenylisoindole-1-carboxylate, methyl 2-phenyl-2H-isoindole-1-carboxylate, J2.877.995J, 2-Phenyl-2H-isoindole-1-carboxylic acid methyl ester, RefChem:354462
| Molecular Formula | C16H13NO2 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.09464 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 56365-73-2 |
|---|---|
| SMILES | COC(=O)C1=C2C=CC=CC2=CN1C3=CC=CC=C3 |
| InChIKey | OFHZBYVQHHEDHE-UHFFFAOYSA-N |
Product Overview
Methyl 2-phenylisoindole-1-carboxylate (CAS 56365-73-2), with molecular formula C16H13NO2 and molecular weight 251.09 g/mol. IUPAC: methyl 2-phenylisoindole-1-carboxylate.
Chemical Property Profile of Methyl 2-phenylisoindole-1-carboxylate
Property Insights of Methyl 2-phenylisoindole-1-carboxylate
The XLogP value of 3.8 indicates that Methyl 2-phenylisoindole-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, Methyl 2-phenylisoindole-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-phenylisoindole-1-carboxylate has 0 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 Methyl 2-phenylisoindole-1-carboxylate?
The CAS number of Methyl 2-phenylisoindole-1-carboxylate is 56365-73-2.
What is the molecular formula of Methyl 2-phenylisoindole-1-carboxylate?
The molecular formula of Methyl 2-phenylisoindole-1-carboxylate is C16H13NO2.
What is the molecular weight of Methyl 2-phenylisoindole-1-carboxylate?
The molecular weight of Methyl 2-phenylisoindole-1-carboxylate is 251.09 g/mol.
Where can I buy Methyl 2-phenylisoindole-1-carboxylate?
You can request a quote for Methyl 2-phenylisoindole-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-phenylisoindole-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-phenylisoindole-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.