TL;DR: RefChem:284332 (CAS 118449-23-3) is a chemical compound with molecular formula C20H21Cl2N3OS and molecular weight 421.07825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-3-(3-chloro-2-methylphenyl)-2-[3-(dimethylamino)propylsulfanyl]quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 7-chloro-3-(3-chloro-2-methylphenyl)-2-((3-(dimethylamino)propyl)thio)-, 7-Chloro-3-(3-chloro-2-methylphenyl)-2-((3-(dimethylamino)propyl)thio)-4(3H)-quinazolinone, 7-chloro-3-(3-chloro-2-methylphenyl)-2-[3-(dimethylamino)propylsulfanyl]quinazolin-4-one, 7-Chloro-3-(3-chloro-2-methylphenyl)-2-{[3-(dimethylamino)propyl]sulfanyl}quinazolin-4(3H)-one
| Molecular Formula | C20H21Cl2N3OS |
| Molecular Weight | 421.07825 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 61.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.07825 Da |
| Heavy Atoms | 27 |
| Complexity | 559.0 |
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCCN(C)C |
| InChIKey | FFTSJFCINJLDDR-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that RefChem:284332 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284332. Following Lipinski's Rule of Five, RefChem:284332 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:284332 is 118449-23-3.
The molecular formula of RefChem:284332 is C20H21Cl2N3OS.
The molecular weight of RefChem:284332 is 421.07825 g/mol.
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