BRD-K55773827-001-01-0
TL;DR: BRD-K55773827-001-01-0 (CAS 401631-34-3) is a chemical compound with molecular formula C25H30BrN3O4 and molecular weight 515.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5-methoxy-1-phenylindole-3-carboxylate
Also Known As: BRD-K55773827-001-01-0, ethyl 6-bromo-2-((4-(2-hydroxyethyl)piperazin-1-yl)methyl)-5-methoxy-1-phenyl-1H-indole-3-carboxylate, Ethyl 6-bromo-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5-methoxy-1-phenyl-indole-3-carboxylate, ethyl 6-bromo-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5-methoxy-1-phenylindole-3-carboxylate, ethyl 6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-5-methoxy-1-phenyl-1H-indole-3-carboxylate
| Molecular Formula | C25H30BrN3O4 |
|---|---|
| Molecular Weight | 515.14 g/mol |
| LogP | 3.6882 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 515.14197 |
| Heavy Atoms | 33 |
| Complexity | 1108.0327 |
Chemical Identifiers
| CAS Number | 401631-34-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CN4CCN(CC4)CCO |
Product Overview
BRD-K55773827-001-01-0 (CAS 401631-34-3), with molecular formula C25H30BrN3O4 and molecular weight 515.14 g/mol. IUPAC: ethyl 6-bromo-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5-methoxy-1-phenylindole-3-carboxylate.
Chemical Property Profile of BRD-K55773827-001-01-0
Property Insights of BRD-K55773827-001-01-0
The XLogP value of 3.6882 indicates that BRD-K55773827-001-01-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K55773827-001-01-0. Following Lipinski's Rule of Five, BRD-K55773827-001-01-0 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRD-K55773827-001-01-0?
The CAS number of BRD-K55773827-001-01-0 is 401631-34-3.
What is the molecular formula of BRD-K55773827-001-01-0?
The molecular formula of BRD-K55773827-001-01-0 is C25H30BrN3O4.
What is the molecular weight of BRD-K55773827-001-01-0?
The molecular weight of BRD-K55773827-001-01-0 is 515.14 g/mol.
Where can I buy BRD-K55773827-001-01-0?
You can request a quote for BRD-K55773827-001-01-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K55773827-001-01-0?
Yes, KEHONG BIO provides custom synthesis services for BRD-K55773827-001-01-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.