2-(3-methyl-4-nitrobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-(3-methyl-4-nitrobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
2-(3-methyl-4-nitrobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3365-7136 |
| Compound Name: | 2-(3-methyl-4-nitrobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C18 H19 N3 O4 S |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1c(C(N)=O)c2CCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9085 |
| logD: | 0.6328 |
| logSw: | -3.5423 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.515 |
| InChI Key: | NXYXTVHWTCQGAI-UHFFFAOYSA-N |