N-(3-chloro-4-fluorophenyl)-8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(3-chloro-4-fluorophenyl)-8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E475-0342 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 358.75 |
| Molecular Formula: | C18 H12 Cl F N2 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)c(C(Nc2ccc(c(c2)[Cl])F)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.5228 |
| logD: | 4.438 |
| logSw: | -4.6151 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.86 |
| InChI Key: | SHGVPOHCRJGJEO-UHFFFAOYSA-N |