N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-1H-indazol-1-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-1H-indazol-1-yl)-4-oxobutanamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-1H-indazol-1-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E002-1063 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-1H-indazol-1-yl)-4-oxobutanamide |
| Molecular Weight: | 430.3 |
| Molecular Formula: | C20 H20 Br N3 O3 |
| Smiles: | Cc1c2ccccc2n(C(CCC(NCc2cc(ccc2OC)[Br])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7464 |
| logD: | 2.7463 |
| logSw: | -3.1997 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.93 |
| InChI Key: | KLTSVHBHBMZUNZ-UHFFFAOYSA-N |