TL;DR: RefChem:283663 (CAS 20887-31-4) is a chemical compound with molecular formula C18H19Cl2N3O2 and molecular weight 379.08542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-chlorophenyl)-1-[2-(dimethylamino)acetyl]-2H-quinazolin-4-one;hydrochloride
Also Known As: 4(1H)-Quinazolinone, 2,3-dihydro-3-(m-chlorophenyl)-1-(dimethylaminoacetyl)-, hydrochloride, 2,3-Dihydro-3-(m-chlorophenyl)-1-(dimethylaminoacetyl)-4(1H)-quinazolinone hydrochloride, 3-(3-Chlorophenyl)-1-[2-(dimethylamino)acetyl]-2H-quinazolin-4-onehydrochloride, 3-(3-chlorophenyl)-1-[2-(dimethylamino)acetyl]-2H-quinazolin-4-one hydrochloride, 3-(3-Chlorophenyl)-1-[(dimethylamino)acetyl]-2,3-dihydroquinazolin-4(1H)-one--hydrogen chloride (1/1)
| Molecular Formula | C18H19Cl2N3O2 |
| Molecular Weight | 379.08542 g/mol |
| XLogP | 3.27 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.08542 Da |
| Heavy Atoms | 25 |
| Complexity | 485.0 |
| SMILES | CN(C)CC(=O)N1CN(C(=O)C2=CC=CC=C21)C3=CC(=CC=C3)Cl.Cl |
| InChIKey | XWTPVTFMHDIRAN-UHFFFAOYSA-N |
The XLogP value of 3.27 indicates that RefChem:283663 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:283663 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:283663 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:283663 is 20887-31-4.
The molecular formula of RefChem:283663 is C18H19Cl2N3O2.
The molecular weight of RefChem:283663 is 379.08542 g/mol.
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