N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y205-4052 |
| Compound Name: | N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C16 H16 N2 O3 S |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)NC(c1csc2CCCCc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1651 |
| logD: | 4.1542 |
| logSw: | -4.3518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.651 |
| InChI Key: | RSVFJSRDFOSZRF-UHFFFAOYSA-N |