TL;DR: Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester (CAS 149848-11-3) is a chemical compound with molecular formula C34H36N2O2 and molecular weight 504.27768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(4-benzhydrylpiperazin-1-yl)-1-phenylpropyl] 2-phenylacetate
Also Known As: 3-(4-(Diphenylmethyl)-1-piperazinyl)-1-phenylpropyl benzeneacetate, [3-(4-benzhydrylpiperazin-1-yl)-1-phenylpropyl] 2-phenylacetate, Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester, 3-[4-(Diphenylmethyl)piperazin-1-yl]-1-phenylpropyl phenylacetate, BENZENEACETIC ACID, 3-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)-1-PHENYLPROPY L ESTER
| Molecular Formula | C34H36N2O2 |
| Molecular Weight | 504.27768 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 504.27768 Da |
| Heavy Atoms | 38 |
| Complexity | 648.0 |
| SMILES | C1CN(CCN1CCC(C2=CC=CC=C2)OC(=O)CC3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | IDJWQLULMCXPKL-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester is 149848-11-3.
The molecular formula of Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester is C34H36N2O2.
The molecular weight of Benzeneacetic acid, 3-(4-(diphenylmethyl)-1-piperazinyl)-1-phenylpropyl ester is 504.27768 g/mol.
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