3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0575 |
| Compound Name: | 3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 521.66 |
| Molecular Formula: | C26 H27 N5 O3 S2 |
| Smiles: | CCN1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N2CCN(CC2)c2ccc(cc2)OC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7313 |
| logD: | 3.7313 |
| logSw: | -4.0486 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 55.057 |
| InChI Key: | PNHJGTMWUJZRRF-UHFFFAOYSA-N |