8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one
TL;DR: 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one (CAS 896857-71-9) is a chemical compound with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethoxy-3-[2-(4-methoxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 8-ethoxy-3-(4-methoxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 8-ethoxy-3-[2-(4-methoxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one, 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one, 8-ethoxy-3-[2-(4-methoxyphenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one, Opera_ID_1711
| Molecular Formula | C21H21N3O3 |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 3.5278 |
| Topological Polar Surface Area | 69.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.1583 |
| Heavy Atoms | 27 |
| Complexity | 1143.224 |
Chemical Identifiers
| CAS Number | 896857-71-9 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCC4=CC=C(C=C4)OC |
Product Overview
8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one (CAS 896857-71-9), with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol. IUPAC: 8-ethoxy-3-[2-(4-methoxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one
Property Insights of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one
The XLogP value of 3.5278 indicates that 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one. Following Lipinski's Rule of Five, 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one has 1 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 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one?
The CAS number of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one is 896857-71-9.
What is the molecular formula of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one?
The molecular formula of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one is C21H21N3O3.
What is the molecular weight of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one?
The molecular weight of 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one is 363.16 g/mol.
Where can I buy 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one?
You can request a quote for 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Ethoxy-3-[2-(4-methoxy-phenyl)-ethyl]-3,5-dihydro-pyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.