![3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide structure](/static/products/6282/628272-92-4.webp)
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
TL;DR: 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide (CAS 628272-92-4) is a chemical compound with molecular formula C21H16N4O4S2 and molecular weight 452.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dioxoisoindol-2-yl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
Also Known As: 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide, 3-(1,3-dioxoisoindol-2-yl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
| Molecular Formula | C21H16N4O4S2 |
|---|---|
| Molecular Weight | 452.06 g/mol |
| LogP | 3.1379 |
| Topological Polar Surface Area | 109.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.0613 |
| Heavy Atoms | 31 |
| Complexity | 1127.9512 |
Chemical Identifiers
| CAS Number | 628272-92-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O |
Product Overview
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide (CAS 628272-92-4), with molecular formula C21H16N4O4S2 and molecular weight 452.06 g/mol. IUPAC: 3-(1,3-dioxoisoindol-2-yl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide.
Chemical Property Profile of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
Property Insights of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
The XLogP value of 3.1379 indicates that 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide. Following Lipinski's Rule of Five, 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide has 1 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 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide?
The CAS number of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide is 628272-92-4.
What is the molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide?
The molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide is C21H16N4O4S2.
What is the molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide?
The molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide is 452.06 g/mol.
Where can I buy 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide?
You can request a quote for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-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 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.