A0139/0006125
TL;DR: A0139/0006125 (CAS 339207-23-7) is a chemical compound with molecular formula C28H34BrN3O3 and molecular weight 539.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-[(4-phenylpiperazin-1-yl)methyl]indole-3-carboxylate
Also Known As: A0139/0006125, BRD-K42028499-001-01-2, ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-[(4-phenylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate, ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-[(4-phenylpiperazin-1-yl)methyl]indole-3-carboxylate, ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-((4-phenylpiperazin-1-yl)methyl)-1H-indole-3-carboxylate
| Molecular Formula | C28H34BrN3O3 |
|---|---|
| Molecular Weight | 539.18 g/mol |
| LogP | 6.1135 |
| Topological Polar Surface Area | 57.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.17834 |
| Heavy Atoms | 35 |
| Complexity | 1179.3708 |
Chemical Identifiers
| CAS Number | 339207-23-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C3CCCCC3)CN4CCN(CC4)C5=CC=CC=C5 |
Product Overview
A0139/0006125 (CAS 339207-23-7), with molecular formula C28H34BrN3O3 and molecular weight 539.18 g/mol. IUPAC: ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-[(4-phenylpiperazin-1-yl)methyl]indole-3-carboxylate.
Chemical Property Profile of A0139/0006125
Property Insights of A0139/0006125
The XLogP value of 6.1135 indicates that A0139/0006125 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.94 Ų, A0139/0006125 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A0139/0006125 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 A0139/0006125?
The CAS number of A0139/0006125 is 339207-23-7.
What is the molecular formula of A0139/0006125?
The molecular formula of A0139/0006125 is C28H34BrN3O3.
What is the molecular weight of A0139/0006125?
The molecular weight of A0139/0006125 is 539.18 g/mol.
Where can I buy A0139/0006125?
You can request a quote for A0139/0006125 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0139/0006125?
Yes, KEHONG BIO provides custom synthesis services for A0139/0006125 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.