4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-2-yl)methyl]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-[(pyridin-2-yl)methyl]butanamide
4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-5262 |
| Compound Name: | 4-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)-N-[(pyridin-2-yl)methyl]butanamide |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C19 H18 N4 O4 S |
| Smiles: | C(CC(NCc1ccccn1)=O)CN1C(c2cc3c(cc2NC1=S)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3316 |
| logD: | 1.3095 |
| logSw: | -2.4452 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.426 |
| InChI Key: | MEHIIZNLCZVFCU-UHFFFAOYSA-N |