F3098-8360
TL;DR: F3098-8360 (CAS 544682-92-0) is a chemical compound with molecular formula C22H27NO3S and molecular weight 385.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-tert-butyl-2-[(2-phenylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F3098-8360, METHYL 6-TERT-BUTYL-2-(2-PHENYLACETAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 6-(tert-butyl)-2-(2-phenylacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 6-tert-butyl-2-[(2-phenylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-(tert-butyl)-2-(2-phenylacetylamino)-4,5,6,7-tetrahydrobenzo[b]thioph ene-3-carboxylate
| Molecular Formula | C22H27NO3S |
|---|---|
| Molecular Weight | 385.17 g/mol |
| LogP | 4.8669 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.17117 |
| Heavy Atoms | 27 |
| Complexity | 833.23303 |
Chemical Identifiers
| CAS Number | 544682-92-0 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CC3=CC=CC=C3 |
Product Overview
F3098-8360 (CAS 544682-92-0), with molecular formula C22H27NO3S and molecular weight 385.17 g/mol. IUPAC: methyl 6-tert-butyl-2-[(2-phenylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F3098-8360
Property Insights of F3098-8360
The XLogP value of 4.8669 indicates that F3098-8360 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, F3098-8360 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F3098-8360 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 F3098-8360?
The CAS number of F3098-8360 is 544682-92-0.
What is the molecular formula of F3098-8360?
The molecular formula of F3098-8360 is C22H27NO3S.
What is the molecular weight of F3098-8360?
The molecular weight of F3098-8360 is 385.17 g/mol.
Where can I buy F3098-8360?
You can request a quote for F3098-8360 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3098-8360?
Yes, KEHONG BIO provides custom synthesis services for F3098-8360 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.