5-oxo-N-(prop-2-en-1-yl)-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
5-oxo-N-(prop-2-en-1-yl)-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
5-oxo-N-(prop-2-en-1-yl)-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F083-0413 |
Compound Name: | 5-oxo-N-(prop-2-en-1-yl)-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
Molecular Weight: | 361.4 |
Molecular Formula: | C15 H11 N3 O4 S2 |
Smiles: | C=CCNC(C1=C2NC(c3cc4c(cc3N2C(=S)S1)OCO4)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6444 |
logD: | 1.6444 |
logSw: | -2.6683 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.618 |
InChI Key: | AZJAQPARSDOBQI-UHFFFAOYSA-N |