2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid
TL;DR: 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid (CAS 78233-93-9) is a chemical compound with molecular formula C13H9ClN2O5 and molecular weight 308.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid
Also Known As: U-58176, 2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid, 3-chloro-4,5-dihydro-alpha-phthalimido-5-isoxazole acetic acid, 3chloro-4,5-dihydro-alpha-phthalimido-5-isoxazole acetic acid, 2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindo
| Molecular Formula | C13H9ClN2O5 |
|---|---|
| Molecular Weight | 308.02 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.02 |
| Heavy Atoms | 21 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 78233-93-9 |
|---|---|
| SMILES | C1C(ON=C1Cl)C(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | YSYDEQSAOVAFIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid (CAS 78233-93-9), with molecular formula C13H9ClN2O5 and molecular weight 308.02 g/mol. IUPAC: 2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid.
Chemical Property Profile of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid
Property Insights of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid. Following Lipinski's Rule of Five, 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid has 1 hydrogen bond donor(s) and 6 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 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid?
The CAS number of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid is 78233-93-9.
What is the molecular formula of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid?
The molecular formula of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid is C13H9ClN2O5.
What is the molecular weight of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid?
The molecular weight of 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid is 308.02 g/mol.
Where can I buy 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid?
You can request a quote for 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-(1,3-dioxoisoindol-2-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.