4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(2-phenylethyl)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-(2-phenylethyl)butanamide
4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(2-phenylethyl)butanamide
Compound characteristics
| Compound ID: | K284-5255 |
| Compound Name: | 4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-(2-phenylethyl)butanamide |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | C(CC(NCCc1ccccc1)=O)CN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0161 |
| logD: | 1.9943 |
| logSw: | -3.0737 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.725 |
| InChI Key: | UJYGRXVQMHPHDH-UHFFFAOYSA-N |