methyl 3-[(3-chlorophenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(3-chlorophenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[(3-chlorophenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0091 |
| Compound Name: | methyl 3-[(3-chlorophenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 334.71 |
| Molecular Formula: | C15 H11 Cl N2 O5 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8907 |
| logD: | 3.7384 |
| logSw: | -4.3294 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.885 |
| InChI Key: | SSEVBROPSKZFQT-UHFFFAOYSA-N |