N-(2-cyanoethyl)-8-methyl-N-phenyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-8-methyl-N-phenyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(2-cyanoethyl)-8-methyl-N-phenyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E475-0549 |
| Compound Name: | N-(2-cyanoethyl)-8-methyl-N-phenyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 359.38 |
| Molecular Formula: | C21 H17 N3 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)c(C(N(CCC#N)c2ccccc2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.2656 |
| logD: | 3.2656 |
| logSw: | -3.4693 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.861 |
| InChI Key: | KXNFZTOYENYNQP-UHFFFAOYSA-N |