NCI60_001562
TL;DR: NCI60_001562 (CAS 88620-56-8) is a chemical compound with molecular formula C20H24N2O6S and molecular weight 420.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(1,3-dioxoisoindol-2-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Also Known As: NCI60_001562, 2-[2-tert-butoxy-1-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, 2-(2-tert-butoxy-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-oxoethyl)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, 2-[1-(1,3-dioxoisoindol-2-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, 2H-Isoindole-2-aceticacid, a-(4-carboxy-5,5-dimethyl-2-thiazolidinyl)-1,3-dihydro-1,3-dioxo-,2-(1,1-dimethylethyl) ester
| Molecular Formula | C20H24N2O6S |
|---|---|
| Molecular Weight | 420.14 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.1355 |
| Heavy Atoms | 29 |
| Complexity | 707.0 |
Chemical Identifiers
| CAS Number | 88620-56-8 |
|---|---|
| SMILES | CC1(C(NC(S1)C(C(=O)OC(C)(C)C)N2C(=O)C3=CC=CC=C3C2=O)C(=O)O)C |
| InChIKey | QGIHHNDVUYFYBK-UHFFFAOYSA-N |
Product Overview
NCI60_001562 (CAS 88620-56-8), with molecular formula C20H24N2O6S and molecular weight 420.14 g/mol. IUPAC: 2-[1-(1,3-dioxoisoindol-2-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of NCI60_001562
Property Insights of NCI60_001562
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCI60_001562. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_001562. Following Lipinski's Rule of Five, NCI60_001562 has 2 hydrogen bond donor(s) and 8 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 NCI60_001562?
The CAS number of NCI60_001562 is 88620-56-8.
What is the molecular formula of NCI60_001562?
The molecular formula of NCI60_001562 is C20H24N2O6S.
What is the molecular weight of NCI60_001562?
The molecular weight of NCI60_001562 is 420.14 g/mol.
Where can I buy NCI60_001562?
You can request a quote for NCI60_001562 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_001562?
Yes, KEHONG BIO provides custom synthesis services for NCI60_001562 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.