TimTec1_003057
TL;DR: TimTec1_003057 (CAS 625377-24-4) is a chemical compound with molecular formula C19H17F3N2O2S2 and molecular weight 426.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-cyclopropyl-2-[2-(4-methylphenyl)sulfonylethylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: TimTec1_003057, BAS 06901182, J2.578.546K, AM-807/41463255, 6-cyclopropyl-2-{[2-(4-methylbenzenesulfonyl)ethyl]sulfanyl}-4-(trifluoromethyl)pyridine-3-carbonitrile
| Molecular Formula | C19H17F3N2O2S2 |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 4.7239 |
| Topological Polar Surface Area | 70.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.06836 |
| Heavy Atoms | 28 |
| Complexity | 1022.8699 |
Chemical Identifiers
| CAS Number | 625377-24-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C(=CC(=N2)C3CC3)C(F)(F)F)C#N |
Product Overview
TimTec1_003057 (CAS 625377-24-4), with molecular formula C19H17F3N2O2S2 and molecular weight 426.07 g/mol. IUPAC: 6-cyclopropyl-2-[2-(4-methylphenyl)sulfonylethylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of TimTec1_003057
Property Insights of TimTec1_003057
The XLogP value of 4.7239 indicates that TimTec1_003057 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.82 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_003057. Following Lipinski's Rule of Five, TimTec1_003057 has 0 hydrogen bond donor(s) and 5 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_003057?
The CAS number of TimTec1_003057 is 625377-24-4.
What is the molecular formula of TimTec1_003057?
The molecular formula of TimTec1_003057 is C19H17F3N2O2S2.
What is the molecular weight of TimTec1_003057?
The molecular weight of TimTec1_003057 is 426.07 g/mol.
Where can I buy TimTec1_003057?
You can request a quote for TimTec1_003057 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_003057?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_003057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.