methyl 3-(3-bromo-4-methoxybenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
Chemical Structure Depiction of
methyl 3-(3-bromo-4-methoxybenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
methyl 3-(3-bromo-4-methoxybenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
Compound characteristics
| Compound ID: | F019-2087 |
| Compound Name: | methyl 3-(3-bromo-4-methoxybenzamido)-4-(4-ethylpiperazin-1-yl)benzoate |
| Molecular Weight: | 476.37 |
| Molecular Formula: | C22 H26 Br N3 O4 |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1NC(c1ccc(c(c1)[Br])OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1678 |
| logD: | 4.1678 |
| logSw: | -4.1785 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.124 |
| InChI Key: | KQHPNBGPFCTYTN-UHFFFAOYSA-N |