N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
TL;DR: N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide (CAS 663168-45-4) is a chemical compound with molecular formula C19H15N3O6S and molecular weight 413.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
Also Known As: N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide, 3-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide, 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
| Molecular Formula | C19H15N3O6S |
|---|---|
| Molecular Weight | 413.07 g/mol |
| LogP | 1.0857 |
| Topological Polar Surface Area | 120.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.06815 |
| Heavy Atoms | 29 |
| Complexity | 1204.1753 |
Chemical Identifiers
| CAS Number | 663168-45-4 |
|---|---|
| SMILES | CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O |
Product Overview
N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide (CAS 663168-45-4), with molecular formula C19H15N3O6S and molecular weight 413.07 g/mol. IUPAC: N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide.
Chemical Property Profile of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
Property Insights of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
The XLogP value of 1.0857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide. The TPSA of 120.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide. Following Lipinski's Rule of Five, N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide 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 N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide?
The CAS number of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide is 663168-45-4.
What is the molecular formula of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide?
The molecular formula of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide is C19H15N3O6S.
What is the molecular weight of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide?
The molecular weight of N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide is 413.07 g/mol.
Where can I buy N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide?
You can request a quote for N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methyl-1,3-dioxoisoindol-5-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.