6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
TL;DR: 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide (CAS 522594-84-9) is a chemical compound with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-N-[(E)-furan-2-ylmethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide, 6-tert-butyl-N'-[(E)-furan-2-ylmethylidene]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide, 6-tert-butyl-N-[(E)-furan-2-ylmethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-((1E)-2-(2-furyl)-1-azavinyl)[6-(tert-butyl)(4,5,6,7-tetrahydrobenzo[b]thiop hen-3-yl)]carboxamide
| Molecular Formula | C18H22N2O2S |
|---|---|
| Molecular Weight | 330.14 g/mol |
| LogP | 4.256 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.1402 |
| Heavy Atoms | 23 |
| Complexity | 707.9573 |
Chemical Identifiers
| CAS Number | 522594-84-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC=C2C(=O)N/N=C/C3=CC=CO3 |
Product Overview
6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide (CAS 522594-84-9), with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol. IUPAC: 6-tert-butyl-N-[(E)-furan-2-ylmethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
Property Insights of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
The XLogP value of 4.256 indicates that 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide has 1 hydrogen bond donor(s) and 4 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 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide?
The CAS number of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide is 522594-84-9.
What is the molecular formula of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide?
The molecular formula of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide is C18H22N2O2S.
What is the molecular weight of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide?
The molecular weight of 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide is 330.14 g/mol.
Where can I buy 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide?
You can request a quote for 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 6-tert-butyl-N'-(2-furylmethylene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.