2-[(3-methoxypropyl)amino]-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[(3-methoxypropyl)amino]-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-[(3-methoxypropyl)amino]-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | 4678-0054 |
Compound Name: | 2-[(3-methoxypropyl)amino]-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 416.52 |
Molecular Formula: | C19 H20 N4 O3 S2 |
Smiles: | COCCCNC1=C(/C=C2/C(N(CC=C)C(=S)S2)=O)C(N2C=CC=CC2=N1)=O |
Stereo: | ACHIRAL |
logP: | 1.7877 |
logD: | 1.7876 |
logSw: | -2.232 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.891 |
InChI Key: | ZDTJTJSZLDHPFU-UHFFFAOYSA-N |