3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-3-yl)methyl]propanamide
Chemical Structure Depiction of
3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-3-yl)methyl]propanamide
3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-3-yl)methyl]propanamide
Compound characteristics
| Compound ID: | K284-5341 |
| Compound Name: | 3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-3-yl)methyl]propanamide |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C18 H16 N4 O4 S |
| Smiles: | C(CN1C(c2cc3c(cc2NC1=S)OCO3)=O)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2669 |
| logD: | 1.2376 |
| logSw: | -2.0709 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.401 |
| InChI Key: | VEORCSCCNIONBH-UHFFFAOYSA-N |