TimTec1_001741
TL;DR: TimTec1_001741 (CAS 306290-72-2) is a chemical compound with molecular formula C21H20N4OS and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
Also Known As: TimTec1_001741, 1-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethanone, 1-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone, 1-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-{[1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl}ethan-1-one, 2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)-1-(2,5-dimethyl-1-(p-tolyl)-1H-pyrrol-3-yl)ethanone
| Molecular Formula | C21H20N4OS |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 4.42026 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.13577 |
| Heavy Atoms | 27 |
| Complexity | 1125.0078 |
Chemical Identifiers
| CAS Number | 306290-72-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CSC3=NN=C4N3C=CC=C4)C |
Product Overview
TimTec1_001741 (CAS 306290-72-2), with molecular formula C21H20N4OS and molecular weight 376.14 g/mol. IUPAC: 1-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone.
Chemical Property Profile of TimTec1_001741
Property Insights of TimTec1_001741
The XLogP value of 4.42026 indicates that TimTec1_001741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, TimTec1_001741 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_001741 has 0 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 TimTec1_001741?
The CAS number of TimTec1_001741 is 306290-72-2.
What is the molecular formula of TimTec1_001741?
The molecular formula of TimTec1_001741 is C21H20N4OS.
What is the molecular weight of TimTec1_001741?
The molecular weight of TimTec1_001741 is 376.14 g/mol.
Where can I buy TimTec1_001741?
You can request a quote for TimTec1_001741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_001741?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_001741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.