7-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Chemical Structure Depiction of
7-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
7-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | K284-5323 |
| Compound Name: | 7-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6-sulfanylidene-6,7-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C23 H24 N4 O4 S |
| Smiles: | C(CN1C(c2cc3c(cc2NC1=S)OCO3)=O)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.257 |
| logD: | 2.1971 |
| logSw: | -3.2318 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.345 |
| InChI Key: | JUXQBROKSAYXMO-UHFFFAOYSA-N |