2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid
Chemical Structure Depiction of
2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid
2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | 8006-0616 |
| Compound Name: | 2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid |
| Molecular Weight: | 345.27 |
| Molecular Formula: | C15 H11 N3 O7 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)NC(c1c(cccc1[N+]([O-])=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0452 |
| logD: | -1.8232 |
| logSw: | -3.5793 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.201 |
| InChI Key: | RUTRIPZHMCLWJH-UHFFFAOYSA-N |