4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(prop-2-en-1-yl)butanamide
Chemical Structure Depiction of
4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(prop-2-en-1-yl)butanamide
4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(prop-2-en-1-yl)butanamide
Compound characteristics
| Compound ID: | K284-5211 |
| Compound Name: | 4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(prop-2-en-1-yl)butanamide |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C16 H17 N3 O4 S |
| Smiles: | C=CCNC(CCCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.976 |
| logD: | 0.9541 |
| logSw: | -2.3425 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.996 |
| InChI Key: | KXJCZHRDMMWJGU-UHFFFAOYSA-N |