TL;DR: RefChem:283652 (CAS 20887-16-5) is a chemical compound with molecular formula C22H26ClN3O2 and molecular weight 399.17136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-methylphenyl)-1-(2-piperidin-1-ylacetyl)-2H-quinazolin-4-one;hydrochloride
Also Known As: 4(1H)-Quinazolinone, 2,3-dihydro-1-(piperidinoacetyl)-3-(p-tolyl)-, hydrochloride, 2,3-Dihydro-1-(piperidinoacetyl)-3-(p-tolyl)-4(1H)-quinazolinone hydrochloride, 1-Piperidinoacetyl-3-(4-methylphenyl)-2,3-dihydro-4(1H)-quinazolinone hydrochloride, 3-(4-Methylphenyl)-1-(2-piperidin-1-ylacetyl)-2H-quinazolin-4-onehydrochloride, 3-(4-methylphenyl)-1-(2-piperidin-1-ylacetyl)-2H-quinazolin-4-one hydrochloride
| Molecular Formula | C22H26ClN3O2 |
| Molecular Weight | 399.17136 g/mol |
| XLogP | 3.85 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.17136 Da |
| Heavy Atoms | 28 |
| Complexity | 538.0 |
| SMILES | CC1=CC=C(C=C1)N2CN(C3=CC=CC=C3C2=O)C(=O)CN4CCCCC4.Cl |
| InChIKey | LANUMOOLGLLMHD-UHFFFAOYSA-N |
The XLogP value of 3.85 indicates that RefChem:283652 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, RefChem:283652 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:283652 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:283652 is 20887-16-5.
The molecular formula of RefChem:283652 is C22H26ClN3O2.
The molecular weight of RefChem:283652 is 399.17136 g/mol.
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