N-{3-[benzyl(methyl)amino]propyl}-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-[benzyl(methyl)amino]propyl}-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
N-{3-[benzyl(methyl)amino]propyl}-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide
Compound characteristics
| Compound ID: | K284-5311 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-3-(8-oxo-6-sulfanylidene-5,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)propanamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | CN(CCCNC(CCN1C(c2cc3c(cc2NC1=S)OCO3)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.227 |
| logD: | 0.7298 |
| logSw: | -3.2568 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.819 |
| InChI Key: | AIEFEDYVAOFWQP-UHFFFAOYSA-N |