N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G851-0917 |
| Compound Name: | N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C20 H22 F N5 O2 |
| Smiles: | CC(C)n1c2ccc(cc2nn1)C(N(C)CC(Nc1ccc(cc1C)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1695 |
| logD: | 2.1693 |
| logSw: | -2.8695 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.006 |
| InChI Key: | JHLWMLYFFDQSLS-UHFFFAOYSA-N |