N-benzyl-N-[2-(pyrrolidine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide
Chemical Structure Depiction of
N-benzyl-N-[2-(pyrrolidine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide
N-benzyl-N-[2-(pyrrolidine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide
Compound characteristics
| Compound ID: | J019-0863 |
| Compound Name: | N-benzyl-N-[2-(pyrrolidine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide |
| Molecular Weight: | 414.54 |
| Molecular Formula: | C21 H22 N2 O3 S2 |
| Smiles: | CS(N(Cc1ccccc1)c1ccc2c(c1)cc(C(N1CCCC1)=O)s2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0525 |
| logD: | 4.0525 |
| logSw: | -4.1054 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.317 |
| InChI Key: | NYIRVHHRUGZHRA-UHFFFAOYSA-N |