![2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione structure](/static/products/3029/302955-06-2.webp)
2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
TL;DR: 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione (CAS 302955-06-2) is a chemical compound with molecular formula C15H8N4O4S and molecular weight 340.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
Also Known As: BAS 00137366, 2-(5-Methyl-[1,3,4]thiadiazol-2-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione, 2-(5-methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione, 2-Methyl-5-(4-nitro-1,8-naphthalimido)-1,3,4-thiadiazole, 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C15H8N4O4S |
|---|---|
| Molecular Weight | 340.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 340.0266 |
| Heavy Atoms | 24 |
| Complexity | 582.0 |
Chemical Identifiers
| CAS Number | 302955-06-2 |
|---|---|
| SMILES | CC1=NN=C(S1)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O |
| InChIKey | PSRMOLGWPSXUTN-UHFFFAOYSA-N |
Product Overview
2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione (CAS 302955-06-2), with molecular formula C15H8N4O4S and molecular weight 340.03 g/mol. IUPAC: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
Property Insights of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 7 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-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The CAS number of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is 302955-06-2.
What is the molecular formula of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is C15H8N4O4S.
What is the molecular weight of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is 340.03 g/mol.
Where can I buy 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Methyl-1,3,4-thiadiazol-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.