![3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/848/848058-97-9.png)
3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 848058-97-9) is a chemical compound with molecular formula C17H22N4O2 and molecular weight 314.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(diethylamino)ethyl]-9-methoxy-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(2-diethylaminoethyl)-9-methoxy-5H-pyrimido[5,4-b]indol-4-one, 3-(2-(diethylamino)ethyl)-9-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C17H22N4O2 |
|---|---|
| Molecular Weight | 314.17 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1743 |
| Heavy Atoms | 23 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 848058-97-9 |
|---|---|
| SMILES | CCN(CC)CCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)OC |
| InChIKey | BNUMUFVSIVTFJR-UHFFFAOYSA-N |
Product Overview
3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 848058-97-9), with molecular formula C17H22N4O2 and molecular weight 314.17 g/mol. IUPAC: 3-[2-(diethylamino)ethyl]-9-methoxy-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one. Following Lipinski's Rule of Five, 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-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 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 848058-97-9.
What is the molecular formula of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C17H22N4O2.
What is the molecular weight of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 314.17 g/mol.
Where can I buy 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-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 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(diethylamino)ethyl]-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.