3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-[(2-methylpropyl)amino]-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]-7-methyl-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | Y070-2370 |
Compound Name: | 3-[(3-cyclopentyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 442.6 |
Molecular Formula: | C22 H26 N4 O2 S2 |
Smiles: | CC(C)CNC1=C(/C=C2/C(N(C3CCCC3)C(=S)S2)=O)C(N2C=C(C)C=CC2=N1)=O |
Stereo: | ACHIRAL |
logP: | 3.605 |
logD: | 3.605 |
logSw: | -3.9019 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.563 |
InChI Key: | NUAJXFAGSVMBAJ-UHFFFAOYSA-N |