ZK 91296
TL;DR: ZK 91296 (CAS 897-21-2) is a chemical compound with molecular formula C23H22N2O4 and molecular weight 390.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(methoxymethyl)-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate
Also Known As: PDSP1_001770, PDSP2_001753, Ethyl 5-benzyloxy-4-methoxymethyl-beta-carboline-3-carboxylate, ethyl 4-(methoxymethyl)-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate, ETHYL 5-(BENZYLOXY)-4-(METHOXYMETHYL)-9H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLATE
| Molecular Formula | C23H22N2O4 |
|---|---|
| Molecular Weight | 390.16 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 73.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.15796 |
| Heavy Atoms | 29 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 897-21-2 |
|---|---|
| SMILES | CCOC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC=C3OCC4=CC=CC=C4 |
| InChIKey | WFPXOWCKXUEKCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ZK 91296 (CAS 897-21-2), with molecular formula C23H22N2O4 and molecular weight 390.16 g/mol. IUPAC: ethyl 4-(methoxymethyl)-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate.
Chemical Property Profile of ZK 91296
Property Insights of ZK 91296
The XLogP value of 4.0 indicates that ZK 91296 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ZK 91296. Following Lipinski's Rule of Five, ZK 91296 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 ZK 91296?
The CAS number of ZK 91296 is 897-21-2.
What is the molecular formula of ZK 91296?
The molecular formula of ZK 91296 is C23H22N2O4.
What is the molecular weight of ZK 91296?
The molecular weight of ZK 91296 is 390.16 g/mol.
Where can I buy ZK 91296?
You can request a quote for ZK 91296 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZK 91296?
Yes, KEHONG BIO provides custom synthesis services for ZK 91296 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.