1,3-二氧代-2-苯基异吲哚啉-5-甲酸
TL;DR: 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 (CAS 4649-27-8) is a chemical compound with molecular formula C15H9NO4 and molecular weight 267.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二氧代-2-苯基异吲哚啉-5-甲酸
1,3-dioxo-2-phenylisoindole-5-carboxylic acid
Also Known As: 1,3-DIOXO-2-PHENYLISOINDOLINE-5-CARBOXYLIC ACID, 4-carboxy-N-phenylphthalimide, 1,3-Dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylic acid, N-Phenylphthalimide-4-carboxylic acid, 1,3-dioxo-2-phenylisoindole-5-carboxylic acid
| Molecular Formula | C15H9NO4 |
|---|---|
| Molecular Weight | 267.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.05316 |
| Heavy Atoms | 20 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 4649-27-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O |
| InChIKey | LJQKDUGNSCMZSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-二氧代-2-苯基异吲哚啉-5-甲酸 (CAS 4649-27-8), with molecular formula C15H9NO4 and molecular weight 267.05 g/mol. IUPAC: 1,3-dioxo-2-phenylisoindole-5-carboxylic acid.
Chemical Property Profile of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸
Property Insights of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-二氧代-2-苯基异吲哚啉-5-甲酸. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-二氧代-2-苯基异吲哚啉-5-甲酸. Following Lipinski's Rule of Five, 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 has 1 hydrogen bond donor(s) and 4 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 1,3-二氧代-2-苯基异吲哚啉-5-甲酸?
The CAS number of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 is 4649-27-8.
What is the molecular formula of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸?
The molecular formula of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 is C15H9NO4.
What is the molecular weight of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸?
The molecular weight of 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 is 267.05 g/mol.
Where can I buy 1,3-二氧代-2-苯基异吲哚啉-5-甲酸?
You can request a quote for 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-二氧代-2-苯基异吲哚啉-5-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二氧代-2-苯基异吲哚啉-5-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.