4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide
TL;DR: 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide (CAS 496010-78-7) is a chemical compound with molecular formula C19H22N2O5 and molecular weight 358.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)benzamide
Also Known As: 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide, 4-butoxy-N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)benzamide, 4-butoxy-N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)benzamide, N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-4-yl)(4-butoxyphenyl)carbox amide, 4-butoxy-N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-octahydro-1H-4,7-epoxyisoindol-2-yl)benzamide
| Molecular Formula | C19H22N2O5 |
|---|---|
| Molecular Weight | 358.15 g/mol |
| LogP | 1.6727 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.15286 |
| Heavy Atoms | 26 |
| Complexity | 703.94995 |
Chemical Identifiers
| CAS Number | 496010-78-7 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NN2C(=O)C3C4CCC(C3C2=O)O4 |
Product Overview
4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide (CAS 496010-78-7), with molecular formula C19H22N2O5 and molecular weight 358.15 g/mol. IUPAC: 4-butoxy-N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)benzamide.
Chemical Property Profile of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide
Property Insights of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide
The XLogP value of 1.6727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)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 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide?
The CAS number of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide is 496010-78-7.
What is the molecular formula of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide?
The molecular formula of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide is C19H22N2O5.
What is the molecular weight of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide?
The molecular weight of 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide is 358.15 g/mol.
Where can I buy 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide?
You can request a quote for 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.