N-(2-acetamidoethyl)-4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)butanamide
Chemical Structure Depiction of
N-(2-acetamidoethyl)-4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)butanamide
N-(2-acetamidoethyl)-4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)butanamide
Compound characteristics
| Compound ID: | K284-5221 |
| Compound Name: | N-(2-acetamidoethyl)-4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)butanamide |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C17 H20 N4 O5 S |
| Smiles: | CC(NCCNC(CCCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7458 |
| logD: | -0.7677 |
| logSw: | -2.0112 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.422 |
| InChI Key: | IGVOGLAICHYSTL-UHFFFAOYSA-N |