N-[(5-bromo-2-methoxyphenyl)methyl]-4-(4-methyl-1H-indazol-1-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(4-methyl-1H-indazol-1-yl)-4-oxobutanamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(4-methyl-1H-indazol-1-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | C791-0882 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-(4-methyl-1H-indazol-1-yl)-4-oxobutanamide |
| Molecular Weight: | 430.3 |
| Molecular Formula: | C20 H20 Br N3 O3 |
| Smiles: | Cc1cccc2c1cnn2C(CCC(NCc1cc(ccc1OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5521 |
| logD: | 3.5521 |
| logSw: | -3.5366 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.577 |
| InChI Key: | JWIIFJBEDYCRRD-UHFFFAOYSA-N |