A2993/0126119
TL;DR: A2993/0126119 (CAS 433251-89-9) is a chemical compound with molecular formula C22H33N3O3 and molecular weight 387.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]indole-3-carboxylate
Also Known As: A2993/0126119, 1-butyl-3-ethoxycarbonyl-2-methyl-4-[(4-methylpiperazin-1-ium-1-yl)methyl]indol-5-olate, ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]indole-3-carboxylate, ethyl 1-butyl-5-hydroxy-2-methyl-4-((4-methylpiperazin-1-yl)methyl)-1H-indole-3-carboxylate, ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate
| Molecular Formula | C22H33N3O3 |
|---|---|
| Molecular Weight | 387.25 g/mol |
| LogP | 3.37952 |
| Topological Polar Surface Area | 57.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.2522 |
| Heavy Atoms | 28 |
| Complexity | 835.39996 |
Chemical Identifiers
| CAS Number | 433251-89-9 |
|---|---|
| SMILES | CCCCN1C(=C(C2=C1C=CC(=C2CN3CCN(CC3)C)O)C(=O)OCC)C |
Product Overview
A2993/0126119 (CAS 433251-89-9), with molecular formula C22H33N3O3 and molecular weight 387.25 g/mol. IUPAC: ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]indole-3-carboxylate.
Chemical Property Profile of A2993/0126119
Property Insights of A2993/0126119
The XLogP value of 3.37952 indicates that A2993/0126119 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.94 Ų, A2993/0126119 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2993/0126119 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 A2993/0126119?
The CAS number of A2993/0126119 is 433251-89-9.
What is the molecular formula of A2993/0126119?
The molecular formula of A2993/0126119 is C22H33N3O3.
What is the molecular weight of A2993/0126119?
The molecular weight of A2993/0126119 is 387.25 g/mol.
Where can I buy A2993/0126119?
You can request a quote for A2993/0126119 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2993/0126119?
Yes, KEHONG BIO provides custom synthesis services for A2993/0126119 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.