3-(2,2-dimethoxyethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-(2,2-dimethoxyethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-(2,2-dimethoxyethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0222 |
| Compound Name: | 3-(2,2-dimethoxyethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 266.32 |
| Molecular Formula: | C12 H14 N2 O3 S |
| Smiles: | COC(CN1C(c2ccccc2NC1=S)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.3769 |
| logD: | 1.3757 |
| logSw: | -2.3764 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.084 |
| InChI Key: | JQXUUFUCKJIOIE-UHFFFAOYSA-N |