6,7-dimethoxy-3-(3-methylbutyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-(3-methylbutyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-dimethoxy-3-(3-methylbutyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0079 |
| Compound Name: | 6,7-dimethoxy-3-(3-methylbutyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 308.4 |
| Molecular Formula: | C15 H20 N2 O3 S |
| Smiles: | CC(C)CCN1C(c2cc(c(cc2NC1=S)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0162 |
| logD: | 2.9943 |
| logSw: | -3.3472 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.829 |
| InChI Key: | MBXKNKWEMBLTGG-UHFFFAOYSA-N |