5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole
TL;DR: 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole (CAS 72023-80-4) is a chemical compound with molecular formula C10H10N4O3S and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitro-2,1,3-benzothiadiazol-5-yl)morpholine
Also Known As: BAS 00318949, 5-(morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole, 5-(4-Morpholinyl)-4-nitro-2,1,3-benzothiadiazole, 4-(4-nitro-2,1,3-benzothiadiazol-5-yl)morpholine, 5-Morpholin-4-yl-4-nitro-benzo[1,2,5]thiadiazole
| Molecular Formula | C10H10N4O3S |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 1.4361 |
| Topological Polar Surface Area | 81.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.04736 |
| Heavy Atoms | 18 |
| Complexity | 593.8204 |
Chemical Identifiers
| CAS Number | 72023-80-4 |
|---|---|
| SMILES | C1COCCN1C2=C(C3=NSN=C3C=C2)[N+](=O)[O-] |
Product Overview
5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole (CAS 72023-80-4), with molecular formula C10H10N4O3S and molecular weight 266.05 g/mol. IUPAC: 4-(4-nitro-2,1,3-benzothiadiazol-5-yl)morpholine.
Chemical Property Profile of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole
Property Insights of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole
The XLogP value of 1.4361 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole. The TPSA of 81.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole. Following Lipinski's Rule of Five, 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole 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 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole?
The CAS number of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole is 72023-80-4.
What is the molecular formula of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole?
The molecular formula of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole is C10H10N4O3S.
What is the molecular weight of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole?
The molecular weight of 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole is 266.05 g/mol.
Where can I buy 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole?
You can request a quote for 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Morpholin-4-yl)-4-nitro-2,1,3-benzothiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.