TL;DR: RefChem:283649 (CAS 20887-26-7) is a chemical compound with molecular formula C18H20ClN3O2 and molecular weight 345.1244 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(dimethylamino)acetyl]-3-phenyl-2H-quinazolin-4-one;hydrochloride
Also Known As: 4(1H)-Quinazolinone, 2,3-dihydro-1-(dimethylaminoacetyl)-3-phenyl-, hydrochloride, 1-[2-(dimethylamino)acetyl]-3-phenyl-2H-quinazolin-4-one hydrochloride, 2,3-Dihydro-1-(dimethylaminoacetyl)-3-phenyl-4(1H)-quinazolinone hydrochloride, 1-[(Dimethylamino)acetyl]-3-phenyl-2,3-dihydroquinazolin-4(1H)-one--hydrogen chloride (1/1)
| Molecular Formula | C18H20ClN3O2 |
| Molecular Weight | 345.1244 g/mol |
| XLogP | 2.62 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.1244 Da |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
| SMILES | CN(C)CC(=O)N1CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3.Cl |
| InChIKey | IYQSBJKINNXZIY-UHFFFAOYSA-N |
The XLogP value of 2.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:283649. With a topological polar surface area (TPSA) of 43.9 Ų, RefChem:283649 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:283649 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:283649 is 20887-26-7.
The molecular formula of RefChem:283649 is C18H20ClN3O2.
The molecular weight of RefChem:283649 is 345.1244 g/mol.
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