N-(2-chloro-4-fluorophenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
N-(2-chloro-4-fluorophenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0025 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 361.76 |
| Molecular Formula: | C17 H13 Cl F N3 O3 |
| Smiles: | Cc1c2c(C=C(C(=N)O2)C(Nc2ccc(cc2[Cl])F)=O)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.0957 |
| logD: | 1.904 |
| logSw: | -3.0511 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.383 |
| InChI Key: | BBUCGTHTVQHEFU-UHFFFAOYSA-N |