N-[(4-methylphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
N-[(4-methylphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
Compound characteristics
| Compound ID: | K284-5326 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C20 H19 N3 O4 S |
| Smiles: | Cc1ccc(CNC(CCN2C(c3cc4c(cc3NC2=S)OCO4)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.918 |
| logD: | 2.8911 |
| logSw: | -3.3812 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.883 |
| InChI Key: | NFUQMZIQQIWNDP-UHFFFAOYSA-N |