ChemDiv1_023571
TL;DR: ChemDiv1_023571 (CAS 406474-41-7) is a chemical compound with molecular formula C27H29NO3S and molecular weight 447.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[8-(2-methylbutan-2-yl)-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl]benzenesulfonamide
Also Known As: ChemDiv1_023571, N-(8-(tert-pentyl)-7,8,9,10-tetrahydronaphtho[1,2-b]benzofuran-5-yl)benzenesulfonamide, AQ-390/40898200, F1113-0172, N-[13-(2-methylbutan-2-yl)-17-oxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(10),2(7),3,5,8,11(16)-hexaen-8-yl]benzenesulfonamide
| Molecular Formula | C27H29NO3S |
|---|---|
| Molecular Weight | 447.19 g/mol |
| LogP | 6.9279 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.18683 |
| Heavy Atoms | 32 |
| Complexity | 1401.397 |
Chemical Identifiers
| CAS Number | 406474-41-7 |
|---|---|
| SMILES | CCC(C)(C)C1CCC2=C(C1)C3=C(O2)C4=CC=CC=C4C(=C3)NS(=O)(=O)C5=CC=CC=C5 |
Product Overview
ChemDiv1_023571 (CAS 406474-41-7), with molecular formula C27H29NO3S and molecular weight 447.19 g/mol. IUPAC: N-[8-(2-methylbutan-2-yl)-7,8,9,10-tetrahydronaphtho[1,2-b][1]benzofuran-5-yl]benzenesulfonamide.
Chemical Property Profile of ChemDiv1_023571
Property Insights of ChemDiv1_023571
The XLogP value of 6.9279 indicates that ChemDiv1_023571 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.31 Ų, ChemDiv1_023571 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023571 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_023571?
The CAS number of ChemDiv1_023571 is 406474-41-7.
What is the molecular formula of ChemDiv1_023571?
The molecular formula of ChemDiv1_023571 is C27H29NO3S.
What is the molecular weight of ChemDiv1_023571?
The molecular weight of ChemDiv1_023571 is 447.19 g/mol.
Where can I buy ChemDiv1_023571?
You can request a quote for ChemDiv1_023571 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023571?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.