3-nitro-2-methyl-N-(4-morpholinyl)benzamide
TL;DR: 3-nitro-2-methyl-N-(4-morpholinyl)benzamide (CAS 5583-80-2) is a chemical compound with molecular formula C12H15N3O4 and molecular weight 265.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-morpholin-4-yl-3-nitrobenzamide
Also Known As: 3-nitro-2-methyl-N-(4-morpholinyl)benzamide, 2-methyl-N-morpholin-4-yl-3-nitrobenzamide, 2-methyl-n-(morpholin-4-yl)-3-nitrobenzamide, 2-methyl-N-4-morpholinyl-3-nitrobenzamide, BIM-0023391.P001
| Molecular Formula | C12H15N3O4 |
|---|---|
| Molecular Weight | 265.11 g/mol |
| LogP | 0.88022 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.10626 |
| Heavy Atoms | 19 |
| Complexity | 497.7479 |
Chemical Identifiers
| CAS Number | 5583-80-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NN2CCOCC2 |
Product Overview
3-nitro-2-methyl-N-(4-morpholinyl)benzamide (CAS 5583-80-2), with molecular formula C12H15N3O4 and molecular weight 265.11 g/mol. IUPAC: 2-methyl-N-morpholin-4-yl-3-nitrobenzamide.
Chemical Property Profile of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide
Property Insights of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide
The XLogP value of 0.88022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-nitro-2-methyl-N-(4-morpholinyl)benzamide. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-nitro-2-methyl-N-(4-morpholinyl)benzamide. Following Lipinski's Rule of Five, 3-nitro-2-methyl-N-(4-morpholinyl)benzamide has 1 hydrogen bond donor(s) and 5 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-nitro-2-methyl-N-(4-morpholinyl)benzamide?
The CAS number of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide is 5583-80-2.
What is the molecular formula of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide?
The molecular formula of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide is C12H15N3O4.
What is the molecular weight of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide?
The molecular weight of 3-nitro-2-methyl-N-(4-morpholinyl)benzamide is 265.11 g/mol.
Where can I buy 3-nitro-2-methyl-N-(4-morpholinyl)benzamide?
You can request a quote for 3-nitro-2-methyl-N-(4-morpholinyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-2-methyl-N-(4-morpholinyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-2-methyl-N-(4-morpholinyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.