TL;DR: RefChem:385471 (CAS 105271-21-4) is a chemical compound with molecular formula C24H22N4O2S and molecular weight 430.14636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-3-(4-methylphenyl)thiourea
Also Known As: Thiourea, N-(3-methoxy-4-(2-methyl-4-oxo-3(4H)-quinazolinyl)phenyl)-N'-(4-methylphenyl)-, N-(3-Methoxy-4-(2-methyl-4-oxo-3(4H)-quinazolinyl)phenyl)-N'-(4-methylphenyl)thiourea, 1-[3-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-3-(4-methylphenyl)thiourea, N-[3-Methoxy-4-(2-methyl-4-oxoquinazolin-3(4H)-yl)phenyl]-N'-(4-methylphenyl)thiourea
| Molecular Formula | C24H22N4O2S |
| Molecular Weight | 430.14636 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.14636 Da |
| Heavy Atoms | 31 |
| Complexity | 691.0 |
| SMILES | CC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C)OC |
| InChIKey | JVCUYNNAOHXTFG-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that RefChem:385471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:385471. Following Lipinski's Rule of Five, RefChem:385471 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:385471 is 105271-21-4.
The molecular formula of RefChem:385471 is C24H22N4O2S.
The molecular weight of RefChem:385471 is 430.14636 g/mol.
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