methyl 3-(4-carbamoylpiperidine-1-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(4-carbamoylpiperidine-1-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
methyl 3-(4-carbamoylpiperidine-1-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0220 |
| Compound Name: | methyl 3-(4-carbamoylpiperidine-1-sulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C16 H17 F N2 O5 S2 |
| Smiles: | COC(c1c(c2c(cccc2s1)F)S(N1CCC(CC1)C(N)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6198 |
| logD: | 1.6198 |
| logSw: | -2.4345 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.929 |
| InChI Key: | ZALUHCNMHLGWIE-UHFFFAOYSA-N |