![3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/372/372089-91-3.png)
3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 372089-91-3) is a chemical compound with molecular formula C17H20N4O and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-piperidin-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(2-piperidin-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one, 3-(2-(piperidin-1-yl)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one, 3-[2-(piperidin-1-yl)ethyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C17H20N4O |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 51.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.1637 |
| Heavy Atoms | 22 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 372089-91-3 |
|---|---|
| SMILES | C1CCN(CC1)CCN2C=NC3=C(C2=O)NC4=CC=CC=C43 |
| InChIKey | USEUDSVEDIHXPA-UHFFFAOYSA-N |
Product Overview
3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 372089-91-3), with molecular formula C17H20N4O and molecular weight 296.16 g/mol. IUPAC: 3-(2-piperidin-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one. With a topological polar surface area (TPSA) of 51.7 Ų, 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one has 1 hydrogen bond donor(s) and 3 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-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 372089-91-3.
What is the molecular formula of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C17H20N4O.
What is the molecular weight of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 296.16 g/mol.
Where can I buy 3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 3-[2-(piperidin-1-yl)ethyl]-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-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(piperidin-1-yl)ethyl]-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.