TimTec1_007538
TL;DR: TimTec1_007538 (CAS 618078-63-0) is a chemical compound with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: TimTec1_007538, BAS 06261202, IDI1_033192, AS-871/41899817, BRD-A42598616-001-02-2
| Molecular Formula | C22H20N2O5S |
|---|---|
| Molecular Weight | 424.11 g/mol |
| LogP | 3.5383 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.10928 |
| Heavy Atoms | 30 |
| Complexity | 1089.1505 |
Chemical Identifiers
| CAS Number | 618078-63-0 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4COC5=CC=CC=C5O4 |
Product Overview
TimTec1_007538 (CAS 618078-63-0), with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol. IUPAC: N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of TimTec1_007538
Property Insights of TimTec1_007538
The XLogP value of 3.5383 indicates that TimTec1_007538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_007538. Following Lipinski's Rule of Five, TimTec1_007538 has 2 hydrogen bond donor(s) and 6 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 TimTec1_007538?
The CAS number of TimTec1_007538 is 618078-63-0.
What is the molecular formula of TimTec1_007538?
The molecular formula of TimTec1_007538 is C22H20N2O5S.
What is the molecular weight of TimTec1_007538?
The molecular weight of TimTec1_007538 is 424.11 g/mol.
Where can I buy TimTec1_007538?
You can request a quote for TimTec1_007538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_007538?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_007538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.