2-[(2-hydroxyethyl)amino]-3-({3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[(2-hydroxyethyl)amino]-3-({3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
2-[(2-hydroxyethyl)amino]-3-({3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-1030 |
| Compound Name: | 2-[(2-hydroxyethyl)amino]-3-({3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C23 H22 N4 O4 S2 |
| Smiles: | CC1C=CC2=NC(=C(/C=C3/C(N(Cc4ccc(cc4)OC)C(=S)S3)=O)C(N2C=1)=O)NCCO |
| Stereo: | ACHIRAL |
| logP: | 2.2855 |
| logD: | 2.2855 |
| logSw: | -2.6478 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.017 |
| InChI Key: | YMEFXPZTQNXJMY-UHFFFAOYSA-N |