N-[(3-methoxyphenyl)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-[(3-methoxyphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
N-[(3-methoxyphenyl)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: | K284-5330 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C20 H19 N3 O5 S |
| Smiles: | COc1cccc(CNC(CCN2C(c3cc4c(cc3NC2=S)OCO4)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5919 |
| logD: | 2.565 |
| logSw: | -3.2044 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.427 |
| InChI Key: | NSRSOFISDUOBJE-UHFFFAOYSA-N |