TL;DR: RefChem:1090888 (CAS 36371-28-5) is a chemical compound with molecular formula C19H33N5O5 and molecular weight 411.24817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,6-dimethylphenyl)-1,4-dipropylpiperazine-2-carboxamide;nitrous acid
Also Known As: 2-Piperazinecarboxanilide, 2',6'-dimethyl-1,4-dipropyl-, dinitrate, 2-Piperazinecarboxamide, N-(2,6-dimethylphenyl)-1,4-dipropyl-, dinitrate, n-(2,6-dimethylphenyl)-1,4-dipropylpiperazine-2-carboxamidentrite(1:2), N-(2,6-Dimethylphenyl)-1,4-dipropylpiperazine-2-carboximidic acid--nitrous acid (1/2), N-(2,6-dimethylphenyl)-1,4-dipropylpiperazine-2-carboxamide; nitrous acid
| Molecular Formula | C19H33N5O5 |
| Molecular Weight | 411.24817 g/mol |
| XLogP | 3.33 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.24817 Da |
| Heavy Atoms | 29 |
| Complexity | 374.0 |
| SMILES | CCCN1CCN(C(C1)C(=O)NC2=C(C=CC=C2C)C)CCC.N(=O)O.N(=O)O |
| InChIKey | HMVVCUFELKIQGF-UHFFFAOYSA-N |
The XLogP value of 3.33 indicates that RefChem:1090888 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1090888. Following Lipinski's Rule of Five, RefChem:1090888 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1090888 is 36371-28-5.
The molecular formula of RefChem:1090888 is C19H33N5O5.
The molecular weight of RefChem:1090888 is 411.24817 g/mol.
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