methyl 3-[(5-methylpyridin-2-yl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(5-methylpyridin-2-yl)carbamoyl]-5-nitrobenzoate
methyl 3-[(5-methylpyridin-2-yl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0495 |
| Compound Name: | methyl 3-[(5-methylpyridin-2-yl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 315.28 |
| Molecular Formula: | C15 H13 N3 O5 |
| Smiles: | Cc1ccc(NC(c2cc(cc(c2)[N+]([O-])=O)C(=O)OC)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 3.257 |
| logD: | 3.0549 |
| logSw: | -3.4567 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.59 |
| InChI Key: | UGPRSBDACGPIRE-UHFFFAOYSA-N |