N-cyclooctyl-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
N-cyclooctyl-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J019-0289 |
| Compound Name: | N-cyclooctyl-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 408.58 |
| Molecular Formula: | C20 H28 N2 O3 S2 |
| Smiles: | CCS(N(C)c1ccc2c(c1)cc(C(NC1CCCCCCC1)=O)s2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0612 |
| logD: | 5.0612 |
| logSw: | -4.8302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.442 |
| InChI Key: | VQMXATMDIYYSME-UHFFFAOYSA-N |