N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide
TL;DR: N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide (CAS 1005112-41-3) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide
Also Known As: N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide, N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-4-ethyl-5-methyl-3-thiophenecarboxamide, N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide, N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-octahydro-1H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide, N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-4-yl)(4-ethyl-5-methyl(3-th ienyl))carboxamide
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 1.42612 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 684.9335 |
Chemical Identifiers
| CAS Number | 1005112-41-3 |
|---|---|
| SMILES | CCC1=C(SC=C1C(=O)NN2C(=O)C3C4CCC(C3C2=O)O4)C |
Product Overview
N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide (CAS 1005112-41-3), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide.
Chemical Property Profile of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide
Property Insights of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide
The XLogP value of 1.42612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide. Following Lipinski's Rule of Five, N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide 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 N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide?
The CAS number of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide is 1005112-41-3.
What is the molecular formula of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide?
The molecular formula of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide is C16H18N2O4S.
What is the molecular weight of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide?
The molecular weight of N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide is 334.10 g/mol.
Where can I buy N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide?
You can request a quote for N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-4-ethyl-5-methylthiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.