Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate
TL;DR: Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate (CAS 7192-60-1) is a chemical compound with molecular formula C27H40N2O9 and molecular weight 536.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropane-1,2,3-tricarboxylic acid;(4-methylpiperazin-1-yl)-(4-prop-2-enoxy-3,5-dipropylphenyl)methanone
Also Known As: Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate, 1-(4-Allyloxy-3,5-dipropylbenzoyl)-4-methylpiperazine citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--(4-methylpiperazin-1-yl){4-[(prop-2-en-1-yl)oxy]-3,5-dipropylphenyl}methanone (1/1), 2-hydroxypropane-1,2,3-tricarboxylic acid; (4-methylpiperazin-1-yl)-(4-prop-2-enoxy-3,5-dipropylphenyl)methanone, RefChem:372351
| Molecular Formula | C27H40N2O9 |
|---|---|
| Molecular Weight | 536.27 g/mol |
| LogP | 2.2955 |
| Topological Polar Surface Area | 165.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 536.2734 |
| Heavy Atoms | 38 |
| Complexity | 629.0 |
Chemical Identifiers
| CAS Number | 7192-60-1 |
|---|---|
| SMILES | CCCC1=CC(=CC(=C1OCC=C)CCC)C(=O)N2CCN(CC2)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | FDTBRAOWOSYUGT-UHFFFAOYSA-N |
Product Overview
Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate (CAS 7192-60-1), with molecular formula C27H40N2O9 and molecular weight 536.27 g/mol. IUPAC: 2-hydroxypropane-1,2,3-tricarboxylic acid;(4-methylpiperazin-1-yl)-(4-prop-2-enoxy-3,5-dipropylphenyl)methanone.
Chemical Property Profile of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate
Property Insights of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate
The XLogP value of 2.2955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate. The TPSA of 165.0 Ų indicates high polarity, suggesting Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate?
The CAS number of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate is 7192-60-1.
What is the molecular formula of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate?
The molecular formula of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate is C27H40N2O9.
What is the molecular weight of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate?
The molecular weight of Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate is 536.27 g/mol.
Where can I buy Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate?
You can request a quote for Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-(4-allyloxy-3,5-dipropylbenzoyl)-4-methyl-, citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.