![3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/896/896826-16-7.png)
3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 896826-16-7) is a chemical compound with molecular formula C23H34N4O2 and molecular weight 398.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(dibutylamino)propyl]-8-ethoxy-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(3-(dibutylamino)propyl)-8-ethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[3-(dibutylamino)propyl]-8-ethoxy-5H-pyrimido[5,4-b]indol-4-one, 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C23H34N4O2 |
|---|---|
| Molecular Weight | 398.27 g/mol |
| LogP | 4.5688 |
| Topological Polar Surface Area | 63.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 398.2682 |
| Heavy Atoms | 29 |
| Complexity | 968.06824 |
Chemical Identifiers
| CAS Number | 896826-16-7 |
|---|---|
| SMILES | CCCCN(CCCC)CCCN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)OCC |
Product Overview
3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 896826-16-7), with molecular formula C23H34N4O2 and molecular weight 398.27 g/mol. IUPAC: 3-[3-(dibutylamino)propyl]-8-ethoxy-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 4.5688 indicates that 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one. Following Lipinski's Rule of Five, 3-[3-(dibutylamino)propyl]-8-ethoxy-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-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 896826-16-7.
What is the molecular formula of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C23H34N4O2.
What is the molecular weight of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 398.27 g/mol.
Where can I buy 3-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 3-[3-(dibutylamino)propyl]-8-ethoxy-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-[3-(dibutylamino)propyl]-8-ethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(dibutylamino)propyl]-8-ethoxy-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.