TimTec1_000001
TL;DR: TimTec1_000001 (CAS 299944-70-0) is a chemical compound with molecular formula C27H28N2O3 and molecular weight 428.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: TimTec1_000001, BAS 01052230, AB00094219-01, cyclopentyl 2-methyl-5-oxo-7-phenyl-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclopentyl 2-methyl-5-oxo-7-phenyl-4-(4-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C27H28N2O3 |
|---|---|
| Molecular Weight | 428.21 g/mol |
| LogP | 4.929 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.21 |
| Heavy Atoms | 32 |
| Complexity | 1082.3993 |
Chemical Identifiers
| CAS Number | 299944-70-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=NC=C4)C(=O)OC5CCCC5 |
Product Overview
TimTec1_000001 (CAS 299944-70-0), with molecular formula C27H28N2O3 and molecular weight 428.21 g/mol. IUPAC: cyclopentyl 2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of TimTec1_000001
Property Insights of TimTec1_000001
The XLogP value of 4.929 indicates that TimTec1_000001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_000001. Following Lipinski's Rule of Five, TimTec1_000001 has 1 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_000001?
The CAS number of TimTec1_000001 is 299944-70-0.
What is the molecular formula of TimTec1_000001?
The molecular formula of TimTec1_000001 is C27H28N2O3.
What is the molecular weight of TimTec1_000001?
The molecular weight of TimTec1_000001 is 428.21 g/mol.
Where can I buy TimTec1_000001?
You can request a quote for TimTec1_000001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_000001?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_000001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.