methyl 3-[(5-chloro-2-methylphenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(5-chloro-2-methylphenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[(5-chloro-2-methylphenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | 3937-0084 |
| Compound Name: | methyl 3-[(5-chloro-2-methylphenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 348.74 |
| Molecular Formula: | C16 H13 Cl N2 O5 |
| Smiles: | Cc1ccc(cc1NC(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7925 |
| logD: | 3.555 |
| logSw: | -4.3476 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.187 |
| InChI Key: | GBJPWDUBXWLDJS-UHFFFAOYSA-N |