TimTec1_000075
TL;DR: TimTec1_000075 (CAS 294873-86-2) is a chemical compound with molecular formula C21H23BrN2O3 and molecular weight 430.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-2-[(dimethylamino)methyl]-5-methoxy-1-phenylindole-3-carboxylate
Also Known As: TimTec1_000075, A0836/0039211, BRD-K72671173-001-01-5, ethyl 6-bromo-2-[(dimethylamino)methyl]-5-methoxy-1-phenyl-1H-indole-3-carboxylate, ethyl 6-bromo-2-((dimethylamino)methyl)-5-methoxy-1-phenyl-1H-indole-3-carboxylate
| Molecular Formula | C21H23BrN2O3 |
|---|---|
| Molecular Weight | 430.09 g/mol |
| LogP | 4.6399 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.0892 |
| Heavy Atoms | 27 |
| Complexity | 964.71234 |
Chemical Identifiers
| CAS Number | 294873-86-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CN(C)C |
Product Overview
TimTec1_000075 (CAS 294873-86-2), with molecular formula C21H23BrN2O3 and molecular weight 430.09 g/mol. IUPAC: ethyl 6-bromo-2-[(dimethylamino)methyl]-5-methoxy-1-phenylindole-3-carboxylate.
Chemical Property Profile of TimTec1_000075
Property Insights of TimTec1_000075
The XLogP value of 4.6399 indicates that TimTec1_000075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, TimTec1_000075 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_000075 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_000075?
The CAS number of TimTec1_000075 is 294873-86-2.
What is the molecular formula of TimTec1_000075?
The molecular formula of TimTec1_000075 is C21H23BrN2O3.
What is the molecular weight of TimTec1_000075?
The molecular weight of TimTec1_000075 is 430.09 g/mol.
Where can I buy TimTec1_000075?
You can request a quote for TimTec1_000075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_000075?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_000075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.