methyl 3-(4'-carbamoyl[1,4'-bipiperidine]-1'-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(4'-carbamoyl[1,4'-bipiperidine]-1'-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-(4'-carbamoyl[1,4'-bipiperidine]-1'-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0232 |
| Compound Name: | methyl 3-(4'-carbamoyl[1,4'-bipiperidine]-1'-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 483.58 |
| Molecular Formula: | C21 H26 F N3 O5 S2 |
| Smiles: | COC(c1c(c2c(cccc2s1)F)S(N1CCC(CC1)(C(N)=O)N1CCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.939 |
| logD: | 2.7054 |
| logSw: | -3.4758 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.006 |
| InChI Key: | CADGYSVKARJBNT-UHFFFAOYSA-N |