2-{[(4-methoxyphenyl)methyl]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-{[(4-methoxyphenyl)methyl]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-{[(4-methoxyphenyl)methyl]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: | 4578-0698 |
| Compound Name: | 2-{[(4-methoxyphenyl)methyl]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: | 464.56 |
| Molecular Formula: | C23 H20 N4 O3 S2 |
| Smiles: | COc1ccc(CNC2=C(/C=C3/C(N(CC=C)C(=S)S3)=O)C(N3C=CC=CC3=N2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8467 |
| logD: | 2.8465 |
| logSw: | -3.3432 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.979 |
| InChI Key: | AYEDDLFAYPAKCG-UHFFFAOYSA-N |