2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione
TL;DR: 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione (CAS 301326-86-3) is a chemical compound with molecular formula C13H13N3O5 and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(morpholin-4-ylmethyl)-4-nitroisoindole-1,3-dione
Also Known As: 2-(morpholinomethyl)-4-nitroisoindoline-1,3-dione, 2-(morpholin-4-ylmethyl)-4-nitroisoindole-1,3-dione, 2-(morpholin-4-ylmethyl)-4-nitro-isoindole-1,3-dione, 2-[(morpholin-4-yl)methyl]-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione, F1225-0001
| Molecular Formula | C13H13N3O5 |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.0855 |
| Heavy Atoms | 21 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 301326-86-3 |
|---|---|
| SMILES | C1COCCN1CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
| InChIKey | HAAATWMYWACGEI-UHFFFAOYSA-N |
Product Overview
2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione (CAS 301326-86-3), with molecular formula C13H13N3O5 and molecular weight 291.09 g/mol. IUPAC: 2-(morpholin-4-ylmethyl)-4-nitroisoindole-1,3-dione.
Chemical Property Profile of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione
Property Insights of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione. Following Lipinski's Rule of Five, 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione has 0 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 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione?
The CAS number of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione is 301326-86-3.
What is the molecular formula of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione?
The molecular formula of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione is C13H13N3O5.
What is the molecular weight of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione?
The molecular weight of 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione is 291.09 g/mol.
Where can I buy 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione?
You can request a quote for 2-(Morpholinomethyl)-4-nitroisoindoline-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-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Morpholinomethyl)-4-nitroisoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.