TimTec1_008049
TL;DR: TimTec1_008049 (CAS 423137-46-6) is a chemical compound with molecular formula C22H23F3N2O3 and molecular weight 420.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-(morpholine-4-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinolin-5-one
Also Known As: TimTec1_008049, BAS 09588809, IDI1_033703, 2-methyl-3-(morpholine-4-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinolin-5-one, 2-methyl-3-(morpholin-4-ylcarbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinolin-5(1H)-one
| Molecular Formula | C22H23F3N2O3 |
|---|---|
| Molecular Weight | 420.17 g/mol |
| LogP | 3.5321 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 420.16608 |
| Heavy Atoms | 30 |
| Complexity | 925.9413 |
Chemical Identifiers
| CAS Number | 423137-46-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)N4CCOCC4 |
Product Overview
TimTec1_008049 (CAS 423137-46-6), with molecular formula C22H23F3N2O3 and molecular weight 420.17 g/mol. IUPAC: 2-methyl-3-(morpholine-4-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinolin-5-one.
Chemical Property Profile of TimTec1_008049
Property Insights of TimTec1_008049
The XLogP value of 3.5321 indicates that TimTec1_008049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, TimTec1_008049 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_008049 has 1 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_008049?
The CAS number of TimTec1_008049 is 423137-46-6.
What is the molecular formula of TimTec1_008049?
The molecular formula of TimTec1_008049 is C22H23F3N2O3.
What is the molecular weight of TimTec1_008049?
The molecular weight of TimTec1_008049 is 420.17 g/mol.
Where can I buy TimTec1_008049?
You can request a quote for TimTec1_008049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_008049?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_008049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.