4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylbutanamide
Chemical Structure Depiction of
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylbutanamide
4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylbutanamide
Compound characteristics
| Compound ID: | K284-7389 |
| Compound Name: | 4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylbutanamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C21 H31 N3 O4 S |
| Smiles: | CCCCCNC(CCCN1C(c2cc(c(cc2NC1=S)OCC)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3029 |
| logD: | 2.2811 |
| logSw: | -2.9907 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.301 |
| InChI Key: | BZMFNHZENWRTSO-UHFFFAOYSA-N |