3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[5-methyl-2-(propan-2-yl)phenoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[5-methyl-2-(propan-2-yl)phenoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[5-methyl-2-(propan-2-yl)phenoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | Y070-3382 |
| Compound Name: | 3-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[5-methyl-2-(propan-2-yl)phenoxy]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C23 H21 N3 O3 S2 |
| Smiles: | CC(C)c1ccc(C)cc1OC1=C(/C=C2/C(N(C)C(=S)S2)=O)C(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2884 |
| logD: | 4.2884 |
| logSw: | -4.4453 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 49.07 |
| InChI Key: | RCNHNHZJRRBGHD-UHFFFAOYSA-N |