![6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide structure](/static/products/5886/588693-34-9.webp)
6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
TL;DR: 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 588693-34-9) is a chemical compound with molecular formula C25H33ClN2O3S and molecular weight 476.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 6-tert-butyl-2-{[(2-chloro-5-methylphenoxy)acetyl]amino}-N-(propan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-{6-(tert-butyl)-3-[N-(methylethyl)carbamoyl](4,5,6,7-tetrahydrobenzo[b]thiop hen-2-yl)}-2-(2-chloro-5-methylphenoxy)acetamide
| Molecular Formula | C25H33ClN2O3S |
|---|---|
| Molecular Weight | 476.19 g/mol |
| LogP | 6.01662 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.19003 |
| Heavy Atoms | 32 |
| Complexity | 1007.34644 |
Chemical Identifiers
| CAS Number | 588693-34-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)Cl)OCC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)NC(C)C |
Product Overview
6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 588693-34-9), with molecular formula C25H33ClN2O3S and molecular weight 476.19 g/mol. IUPAC: 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Property Insights of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
The XLogP value of 6.01662 indicates that 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. Following Lipinski's Rule of Five, 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The CAS number of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 588693-34-9.
What is the molecular formula of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular formula of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is C25H33ClN2O3S.
What is the molecular weight of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular weight of 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 476.19 g/mol.
Where can I buy 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
You can request a quote for 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 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-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-tert-butyl-2-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N-propan-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.