1,3-二氧代-2-异二氢吲哚丁酰胺
TL;DR: 1,3-二氧代-2-异二氢吲哚丁酰胺 (CAS 3459-33-4) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二氧代-2-异二氢吲哚丁酰胺
4-(1,3-dioxoisoindol-2-yl)butanamide
Also Known As: 4-Phthalimidobutyramide, 3-Nitrobenzamidine, 1,3-Dioxo-2-isoindolinebutyramide, Phthalimide, N-(carbamoylpropyl)-, 2-ISOINDOLINEBUTYRAMIDE, 1,3-DIOXO-
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 80.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 3459-33-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)N |
| InChIKey | DEHGEJYFWZKPKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-二氧代-2-异二氢吲哚丁酰胺 (CAS 3459-33-4), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 4-(1,3-dioxoisoindol-2-yl)butanamide.
Chemical Property Profile of 1,3-二氧代-2-异二氢吲哚丁酰胺
Property Insights of 1,3-二氧代-2-异二氢吲哚丁酰胺
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-二氧代-2-异二氢吲哚丁酰胺. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-二氧代-2-异二氢吲哚丁酰胺. Following Lipinski's Rule of Five, 1,3-二氧代-2-异二氢吲哚丁酰胺 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 1,3-二氧代-2-异二氢吲哚丁酰胺?
The CAS number of 1,3-二氧代-2-异二氢吲哚丁酰胺 is 3459-33-4.
What is the molecular formula of 1,3-二氧代-2-异二氢吲哚丁酰胺?
The molecular formula of 1,3-二氧代-2-异二氢吲哚丁酰胺 is C12H12N2O3.
What is the molecular weight of 1,3-二氧代-2-异二氢吲哚丁酰胺?
The molecular weight of 1,3-二氧代-2-异二氢吲哚丁酰胺 is 232.08 g/mol.
Where can I buy 1,3-二氧代-2-异二氢吲哚丁酰胺?
You can request a quote for 1,3-二氧代-2-异二氢吲哚丁酰胺 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-异二氢吲哚丁酰胺?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二氧代-2-异二氢吲哚丁酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.