7-chloro-1-(3-fluoro-4-methylphenyl)-2-(pyridin-3-yl)-1,2,3,5-tetrahydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-chloro-1-(3-fluoro-4-methylphenyl)-2-(pyridin-3-yl)-1,2,3,5-tetrahydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-chloro-1-(3-fluoro-4-methylphenyl)-2-(pyridin-3-yl)-1,2,3,5-tetrahydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C201-0069 |
| Compound Name: | 7-chloro-1-(3-fluoro-4-methylphenyl)-2-(pyridin-3-yl)-1,2,3,5-tetrahydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 437.92 |
| Molecular Formula: | C23 H17 Cl F N3 O S |
| Smiles: | Cc1ccc(cc1F)N1C(c2cccnc2)NC(C2Cc3cc(ccc3OC1=2)[Cl])=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6629 |
| logD: | 5.6627 |
| logSw: | -6.0951 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2136 |
| InChI Key: | IPUGVCZIABJODI-OAQYLSRUSA-N |