N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-4-nitroaniline
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-4-nitroaniline
N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-4-nitroaniline
Compound characteristics
| Compound ID: | Y508-9090 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-4-nitroaniline |
| Molecular Weight: | 351.2 |
| Molecular Formula: | C15 H15 Br N2 O3 |
| Smiles: | Cc1cc(ccc1NCc1cc(ccc1OC)[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.466 |
| logD: | 4.466 |
| logSw: | -4.4951 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.787 |
| InChI Key: | ZMCOVXGPTAAFRX-UHFFFAOYSA-N |