2-[benzyl(methyl)amino]-3-[(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[benzyl(methyl)amino]-3-[(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
2-[benzyl(methyl)amino]-3-[(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 3541-1298 |
| Compound Name: | 2-[benzyl(methyl)amino]-3-[(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 478.63 |
| Molecular Formula: | C25 H26 N4 O2 S2 |
| Smiles: | CCCCN1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N(C)Cc2ccccc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6275 |
| logD: | 4.6275 |
| logSw: | -4.2459 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.009 |
| InChI Key: | NCCNPWCSGBPJRN-UHFFFAOYSA-N |