methyl 3-({2-[(4-methoxyphenyl)carbamoyl]phenyl}carbamoyl)-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-({2-[(4-methoxyphenyl)carbamoyl]phenyl}carbamoyl)-5-nitrobenzoate
methyl 3-({2-[(4-methoxyphenyl)carbamoyl]phenyl}carbamoyl)-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-3777 |
| Compound Name: | methyl 3-({2-[(4-methoxyphenyl)carbamoyl]phenyl}carbamoyl)-5-nitrobenzoate |
| Molecular Weight: | 449.42 |
| Molecular Formula: | C23 H19 N3 O7 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(Nc1ccccc1C(Nc1ccc(cc1)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8788 |
| logD: | 3.8288 |
| logSw: | -4.1794 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.822 |
| InChI Key: | JZTKCRLBLLXJOI-UHFFFAOYSA-N |