5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | 8018-7458 |
Compound Name: | 5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
Molecular Weight: | 347.46 |
Molecular Formula: | C16 H17 N3 O2 S2 |
Smiles: | CCCCCNC(C1=C2NC(c3ccccc3N2C(=S)S1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9973 |
logD: | 2.9973 |
logSw: | -3.7446 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.502 |
InChI Key: | IHKLMPGCYJKBMM-UHFFFAOYSA-N |