TL;DR: Sulmepride (CAS 129230-02-0) is a chemical compound with molecular formula C31H43N3O10 and molecular weight 617.29486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-(2,2-dimethylpropyl)carbamate
Also Known As: Sulmepride, 2-phenoxymethyl-5-nitrobenzoic acid, Carbamic acid, (2,2-dimethylpropyl)-, (1,4-bis(3,4,5-trimethoxybenzoyl)-2-piperazinyl)methyl ester, N,N'-Di-(3',4',5'-trimethoxybenzoyl)-2-N''-tert-amylcarbamoyloxymethylpiperazine, [1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-(2,2-dimethylpropyl)carbamate
| Molecular Formula | C31H43N3O10 |
| Molecular Weight | 617.29486 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 617.29486 Da |
| Heavy Atoms | 44 |
| Complexity | 918.0 |
| SMILES | CC(C)(C)CNC(=O)OCC1CN(CCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC(=C(C(=C3)OC)OC)OC |
| InChIKey | ZJUIACXULIBYQJ-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that Sulmepride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulmepride. Following Lipinski's Rule of Five, Sulmepride has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Sulmepride is 129230-02-0.
The molecular formula of Sulmepride is C31H43N3O10.
The molecular weight of Sulmepride is 617.29486 g/mol.
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