methyl 3-nitro-5-{[(pyridin-3-yl)methyl]carbamoyl}benzoate
Chemical Structure Depiction of
methyl 3-nitro-5-{[(pyridin-3-yl)methyl]carbamoyl}benzoate
methyl 3-nitro-5-{[(pyridin-3-yl)methyl]carbamoyl}benzoate
Compound characteristics
| Compound ID: | 2616-2016 |
| Compound Name: | methyl 3-nitro-5-{[(pyridin-3-yl)methyl]carbamoyl}benzoate |
| Molecular Weight: | 315.28 |
| Molecular Formula: | C15 H13 N3 O5 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5753 |
| logD: | 1.5751 |
| logSw: | -1.4162 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.725 |
| InChI Key: | JVNXHHBYMVIQAW-UHFFFAOYSA-N |