ChemDiv3_004829
TL;DR: ChemDiv3_004829 (CAS 518330-16-0) is a chemical compound with molecular formula C21H25NO3S2 and molecular weight 403.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[8-(2-methylbutan-2-yl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]thiophene-2-sulfonamide
Also Known As: ChemDiv3_004829, IDI1_022739, AQ-390/41638879, N-(8-(tert-pentyl)-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)thiophene-2-sulfonamide, BRD-A70294243-001-01-6
| Molecular Formula | C21H25NO3S2 |
|---|---|
| Molecular Weight | 403.13 g/mol |
| LogP | 5.8362 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.1276 |
| Heavy Atoms | 27 |
| Complexity | 1062.4904 |
Chemical Identifiers
| CAS Number | 518330-16-0 |
|---|---|
| SMILES | CCC(C)(C)C1CCC2=C(C1)C3=C(O2)C=CC(=C3)NS(=O)(=O)C4=CC=CS4 |
Product Overview
ChemDiv3_004829 (CAS 518330-16-0), with molecular formula C21H25NO3S2 and molecular weight 403.13 g/mol. IUPAC: N-[8-(2-methylbutan-2-yl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]thiophene-2-sulfonamide.
Chemical Property Profile of ChemDiv3_004829
Property Insights of ChemDiv3_004829
The XLogP value of 5.8362 indicates that ChemDiv3_004829 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.31 Ų, ChemDiv3_004829 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_004829 has 1 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 ChemDiv3_004829?
The CAS number of ChemDiv3_004829 is 518330-16-0.
What is the molecular formula of ChemDiv3_004829?
The molecular formula of ChemDiv3_004829 is C21H25NO3S2.
What is the molecular weight of ChemDiv3_004829?
The molecular weight of ChemDiv3_004829 is 403.13 g/mol.
Where can I buy ChemDiv3_004829?
You can request a quote for ChemDiv3_004829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004829?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.