8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
TL;DR: 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline (CAS 896842-89-0) is a chemical compound with molecular formula C23H31N5O and molecular weight 393.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(4-ethylpiperazin-1-yl)-8-(2-methylpropyl)-11-oxa-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Also Known As: 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline, 8-(4-ethylpiperazin-1-yl)-5-isobutyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
| Molecular Formula | C23H31N5O |
|---|---|
| Molecular Weight | 393.25 g/mol |
| LogP | 3.9902 |
| Topological Polar Surface Area | 58.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.25287 |
| Heavy Atoms | 29 |
| Complexity | 1032.8418 |
Chemical Identifiers
| CAS Number | 896842-89-0 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=NC=NC3=C2OC4=C3C5=C(CCCC5)C(=N4)CC(C)C |
Product Overview
8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline (CAS 896842-89-0), with molecular formula C23H31N5O and molecular weight 393.25 g/mol. IUPAC: 13-(4-ethylpiperazin-1-yl)-8-(2-methylpropyl)-11-oxa-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene.
Chemical Property Profile of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
Property Insights of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
The XLogP value of 3.9902 indicates that 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.29 Ų, 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline has 0 hydrogen bond donor(s) and 6 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 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline?
The CAS number of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline is 896842-89-0.
What is the molecular formula of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline?
The molecular formula of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline is C23H31N5O.
What is the molecular weight of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline?
The molecular weight of 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline is 393.25 g/mol.
Where can I buy 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline?
You can request a quote for 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.