3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(3-methylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(3-methylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(3-methylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | Y070-4715 |
| Compound Name: | 3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(3-methylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C24 H21 N3 O3 S2 |
| Smiles: | Cc1cccc(c1)OC1=C(/C=C2/C(N(C3CCCC3)C(=S)S2)=O)C(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4596 |
| logD: | 4.4596 |
| logSw: | -4.5167 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 48.534 |
| InChI Key: | HYPQDDSKLZNQMD-UHFFFAOYSA-N |