methyl 3-[(2-methylbutan-2-yl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(2-methylbutan-2-yl)carbamoyl]-5-nitrobenzoate
methyl 3-[(2-methylbutan-2-yl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-3515 |
| Compound Name: | methyl 3-[(2-methylbutan-2-yl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 294.3 |
| Molecular Formula: | C14 H18 N2 O5 |
| Smiles: | CCC(C)(C)NC(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7571 |
| logD: | 2.7571 |
| logSw: | -3.113 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.77 |
| InChI Key: | GPBVREGFDLKKCX-UHFFFAOYSA-N |