3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | K284-6896 |
Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one |
Molecular Weight: | 515.59 |
Molecular Formula: | C28 H25 N3 O5 S |
Smiles: | C1COCCN1c1ccc2c(c1)C(N(Cc1ccc3c(c1)OCO3)C(=N2)SCC(c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9153 |
logD: | 3.9152 |
logSw: | -4.0742 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 67.494 |
InChI Key: | PMNWOHLVXCOBOQ-UHFFFAOYSA-N |