4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)
TL;DR: 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) (CAS 129663-99-6) is a chemical compound with molecular formula C50H64N8O14 and molecular weight 1000.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(but-2-enedioic acid);bis(4-butoxy-2-(4-prop-2-enylpiperazin-1-yl)quinazoline)
Also Known As: 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3), 2-(4-Allyl-1-piperazinyl)-4-butoxyquinazoline fumarate (2:3), Quinazoline, 4-butoxy-2-(4-(2-propenyl)-1-piperazinyl)-, (E)-2-butenedioate (2:3)
| Molecular Formula | C50H64N8O14 |
|---|---|
| Molecular Weight | 1000.45 g/mol |
| LogP | 5.3688 |
| Topological Polar Surface Area | 306.78 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 20 |
| Exact Mass | 1000.4542 |
| Heavy Atoms | 72 |
| Complexity | 2235.2244 |
Chemical Identifiers
| CAS Number | 129663-99-6 |
|---|---|
| SMILES | CCCCOC1=NC(=NC2=CC=CC=C21)N3CCN(CC3)CC=C.CCCCOC1=NC(=NC2=CC=CC=C21)N3CCN(CC3)CC=C.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O |
Product Overview
4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) (CAS 129663-99-6), with molecular formula C50H64N8O14 and molecular weight 1000.45 g/mol. IUPAC: tris(but-2-enedioic acid);bis(4-butoxy-2-(4-prop-2-enylpiperazin-1-yl)quinazoline).
Chemical Property Profile of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)
Property Insights of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)
The XLogP value of 5.3688 indicates that 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 306.78 Ų indicates high polarity, suggesting 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)?
The CAS number of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) is 129663-99-6.
What is the molecular formula of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)?
The molecular formula of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) is C50H64N8O14.
What is the molecular weight of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)?
The molecular weight of 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) is 1000.45 g/mol.
Where can I buy 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)?
You can request a quote for 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3)?
Yes, KEHONG BIO provides custom synthesis services for 4-Butoxy-2-(4-(2-propenyl)-1-piperazinyl)quinazoline (E)-2-butenedioate (2:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.