2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
TL;DR: 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide (CAS 196874-85-8) is a chemical compound with molecular formula C13H14N4O4S and molecular weight 322.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Also Known As: BAS 02994006, 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide, 2-morpholin-4-yl-N-(6-nitrobenzothiazol-2-yl)acetamide, 2-morpholino-N-(6-nitrobenzo[d]thiazol-2-yl)acetamide, 2-Morpholin-4-yl-N-(6-nitro-benzothiazol-2-yl)-acetamide
| Molecular Formula | C13H14N4O4S |
|---|---|
| Molecular Weight | 322.07 g/mol |
| LogP | 1.4752 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.07358 |
| Heavy Atoms | 22 |
| Complexity | 711.12805 |
Chemical Identifiers
| CAS Number | 196874-85-8 |
|---|---|
| SMILES | C1COCCN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-] |
Product Overview
2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide (CAS 196874-85-8), with molecular formula C13H14N4O4S and molecular weight 322.07 g/mol. IUPAC: 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Property Insights of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
The XLogP value of 1.4752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide. Following Lipinski's Rule of Five, 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide has 1 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-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide?
The CAS number of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide is 196874-85-8.
What is the molecular formula of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide?
The molecular formula of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide is C13H14N4O4S.
What is the molecular weight of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide?
The molecular weight of 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide is 322.07 g/mol.
Where can I buy 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide?
You can request a quote for 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-morpholin-4-yl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.