5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline
TL;DR: 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline (CAS 347356-05-2) is a chemical compound with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline
Also Known As: 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline, AB00110149-01, 5-morpholino-2-nitro-N-(pyridin-3-ylmethyl)aniline, (5-Morpholin-4-yl-2-nitro-phenyl)-pyridin-3-ylmethyl-amine, (5-morpholin-4-yl-2-nitrophenyl)(3-pyridylmethyl)amine
| Molecular Formula | C16H18N4O3 |
|---|---|
| Molecular Weight | 314.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.13788 |
| Heavy Atoms | 23 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 347356-05-2 |
|---|---|
| SMILES | C1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3 |
| InChIKey | OVLYFSKVNHAJIL-UHFFFAOYSA-N |
Product Overview
5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline (CAS 347356-05-2), with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol. IUPAC: 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline.
Chemical Property Profile of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline
Property Insights of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline. Following Lipinski's Rule of Five, 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline has 1 hydrogen bond donor(s) and 6 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-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The CAS number of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline is 347356-05-2.
What is the molecular formula of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The molecular formula of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline is C16H18N4O3.
What is the molecular weight of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The molecular weight of 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline is 314.14 g/mol.
Where can I buy 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline?
You can request a quote for 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline 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-2-nitro-N-(pyridin-3-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 5-morpholin-4-yl-2-nitro-N-(pyridin-3-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.