3-Tcim-5,7-deip
TL;DR: 3-Tcim-5,7-deip (CAS 145303-66-8) is a chemical compound with molecular formula C27H25ClN8 and molecular weight 496.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[1-[[2-chloro-6-(2H-tetrazol-5-yl)phenyl]methyl]indol-5-yl]methyl]-2-ethyl-5,7-dimethylimidazo[4,5-b]pyridine
Also Known As: 3-Tcim-5,7-deip, 3-((N-(2-Tetrazol-5-yl-6-chlorobenzyl)-5-indolyl)methyl)-5,7-dimethyl-2-ethyl-3H-imidazo(4,5-b)pyridine, 3-[[1-[[2-chloro-6-(2H-tetrazol-5-yl)phenyl]methyl]indol-5-yl]methyl]-2-ethyl-5,7-dimethylimidazo[4,5-b]pyridine, 3H-Imidazo[4,5-b]pyridine,3-[[1-[[2-chloro-6-(2H-tetrazol-5-yl)phenyl]methyl]-1H-indol-5-yl]methyl]-2-ethyl-5,7-dimethyl-, 3-((N-(2-tetrazol-5-yl-6-chlorobenzyl)-5-indolyl)methyl)-5,7-dimethyl-2-ethyl-3H-imidazo(4,5-b)pyrid
| Molecular Formula | C27H25ClN8 |
|---|---|
| Molecular Weight | 496.19 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.18906 |
| Heavy Atoms | 36 |
| Complexity | 743.0 |
Chemical Identifiers
| CAS Number | 145303-66-8 |
|---|---|
| SMILES | CCC1=NC2=C(N1CC3=CC4=C(C=C3)N(C=C4)CC5=C(C=CC=C5Cl)C6=NNN=N6)N=C(C=C2C)C |
| InChIKey | OVQDHXZVUKADSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Tcim-5,7-deip (CAS 145303-66-8), with molecular formula C27H25ClN8 and molecular weight 496.19 g/mol. IUPAC: 3-[[1-[[2-chloro-6-(2H-tetrazol-5-yl)phenyl]methyl]indol-5-yl]methyl]-2-ethyl-5,7-dimethylimidazo[4,5-b]pyridine.
Chemical Property Profile of 3-Tcim-5,7-deip
Property Insights of 3-Tcim-5,7-deip
The XLogP value of 5.4 indicates that 3-Tcim-5,7-deip is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Tcim-5,7-deip. Following Lipinski's Rule of Five, 3-Tcim-5,7-deip has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Tcim-5,7-deip?
The CAS number of 3-Tcim-5,7-deip is 145303-66-8.
What is the molecular formula of 3-Tcim-5,7-deip?
The molecular formula of 3-Tcim-5,7-deip is C27H25ClN8.
What is the molecular weight of 3-Tcim-5,7-deip?
The molecular weight of 3-Tcim-5,7-deip is 496.19 g/mol.
Where can I buy 3-Tcim-5,7-deip?
You can request a quote for 3-Tcim-5,7-deip directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Tcim-5,7-deip?
Yes, KEHONG BIO provides custom synthesis services for 3-Tcim-5,7-deip and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.