7-[(3-methoxyphenyl)methyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Chemical Structure Depiction of
7-[(3-methoxyphenyl)methyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[(3-methoxyphenyl)methyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5114 |
| Compound Name: | 7-[(3-methoxyphenyl)methyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C17 H14 N2 O4 S |
| Smiles: | COc1cccc(CN2C(c3cc4c(cc3NC2=S)OCO4)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4074 |
| logD: | 3.4003 |
| logSw: | -3.8578 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.977 |
| InChI Key: | RMWFSJRGYSXAQV-UHFFFAOYSA-N |