![3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/895/895903-77-2.png)
3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 895903-77-2) is a chemical compound with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(cyclohexen-1-yl)ethyl]-8-methoxy-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[2-(cyclohexen-1-yl)ethyl]-8-methoxy-5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C19H21N3O2 |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 3.7769 |
| Topological Polar Surface Area | 59.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.1634 |
| Heavy Atoms | 24 |
| Complexity | 981.34503 |
Chemical Identifiers
| CAS Number | 895903-77-2 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CCC4=CCCCC4 |
Product Overview
3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 895903-77-2), with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol. IUPAC: 3-[2-(cyclohexen-1-yl)ethyl]-8-methoxy-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 3.7769 indicates that 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.91 Ų, 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-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-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is 895903-77-2.
What is the molecular formula of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is C19H21N3O2.
What is the molecular weight of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is 323.16 g/mol.
Where can I buy 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-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-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-(cyclohex-1-en-1-yl)ethyl)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.