![2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione structure](/static/products/5484/5484-93-5.webp)
2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
TL;DR: 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (CAS 5484-93-5) is a chemical compound with molecular formula C23H19N3O5 and molecular weight 417.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-nitro-2-phenylmethoxyphenyl)methylideneamino]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
| Molecular Formula | C23H19N3O5 |
|---|---|
| Molecular Weight | 417.13 g/mol |
| LogP | 3.3148 |
| Topological Polar Surface Area | 102.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.13248 |
| Heavy Atoms | 31 |
| Complexity | 1097.2867 |
Chemical Identifiers
| CAS Number | 5484-93-5 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)N=CC4=C(C=CC(=C4)[N+](=O)[O-])OCC5=CC=CC=C5 |
Product Overview
2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (CAS 5484-93-5), with molecular formula C23H19N3O5 and molecular weight 417.13 g/mol. IUPAC: 4-[(5-nitro-2-phenylmethoxyphenyl)methylideneamino]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Property Insights of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
The XLogP value of 3.3148 indicates that 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-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-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The CAS number of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 5484-93-5.
What is the molecular formula of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular formula of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is C23H19N3O5.
What is the molecular weight of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular weight of 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 417.13 g/mol.
Where can I buy 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
You can request a quote for 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-({[2-(Benzyloxy)-5-nitrophenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.