methyl 3-(dibutylcarbamoyl)-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-(dibutylcarbamoyl)-5-nitrobenzoate
methyl 3-(dibutylcarbamoyl)-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0042 |
| Compound Name: | methyl 3-(dibutylcarbamoyl)-5-nitrobenzoate |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C17 H24 N2 O5 |
| Smiles: | CCCCN(CCCC)C(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9943 |
| logD: | 3.9943 |
| logSw: | -4.0776 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.233 |
| InChI Key: | YVHGRKXYQLDYKG-UHFFFAOYSA-N |