![3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one structure](/static/products/899/899382-68-4.png)
3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one
TL;DR: 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one (CAS 899382-68-4) is a chemical compound with molecular formula C20H23N3O and molecular weight 321.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one
Also Known As: 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one, 3-(2-(cyclohex-1-en-1-yl)ethyl)-5,8-dimethyl-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[2-(cyclohex-1-en-1-yl)ethyl]-5,8-dimethyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C20H23N3O |
|---|---|
| Molecular Weight | 321.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 37.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.1841 |
| Heavy Atoms | 24 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 899382-68-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CCC4=CCCCC4)C |
| InChIKey | MMNNGDAQHWQLNC-UHFFFAOYSA-N |
Product Overview
3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one (CAS 899382-68-4), with molecular formula C20H23N3O and molecular weight 321.18 g/mol. IUPAC: 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one
Property Insights of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one
The XLogP value of 3.7 indicates that 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.6 Ų, 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one has 0 hydrogen bond donor(s) and 2 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-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one?
The CAS number of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one is 899382-68-4.
What is the molecular formula of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one?
The molecular formula of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one is C20H23N3O.
What is the molecular weight of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one?
The molecular weight of 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one is 321.18 g/mol.
Where can I buy 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one?
You can request a quote for 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[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-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(cyclohexen-1-yl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.