2-[({6-(4-fluorophenyl)-3-[(furan-2-yl)methyl]-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[({6-(4-fluorophenyl)-3-[(furan-2-yl)methyl]-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2-[({6-(4-fluorophenyl)-3-[(furan-2-yl)methyl]-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | K286-4252 |
| Compound Name: | 2-[({6-(4-fluorophenyl)-3-[(furan-2-yl)methyl]-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 549.62 |
| Molecular Formula: | C25 H16 F N5 O3 S3 |
| Smiles: | C(c1ccco1)N1C2=C(C(N(C(=N2)SCC2=CC(N3C=CC=CC3=N2)=O)c2ccc(cc2)F)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.7622 |
| logD: | 3.7622 |
| logSw: | -4.1793 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 61.301 |
| InChI Key: | HAYRBCHRASEVGY-UHFFFAOYSA-N |