TL;DR: N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide (CAS 1016488-68-8) is a chemical compound with molecular formula C19H22N4O2S and molecular weight 370.14636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide
Also Known As: N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide, N-(1-cyanocyclohexyl)-2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
| Molecular Formula | C19H22N4O2S |
| Molecular Weight | 370.14636 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.14636 Da |
| Heavy Atoms | 26 |
| Complexity | 633.0 |
| SMILES | CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3(CCCCC3)C#N |
| InChIKey | XBGZOBXDKDYJHQ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide. Following Lipinski's Rule of Five, N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide is 1016488-68-8.
The molecular formula of N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide is C19H22N4O2S.
The molecular weight of N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide is 370.14636 g/mol.
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