N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromothiophene-2-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromothiophene-2-sulfonyl)piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromothiophene-2-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C274-0442 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromothiophene-2-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 487.39 |
| Molecular Formula: | C18 H19 Br N2 O5 S2 |
| Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8769 |
| logD: | 2.8769 |
| logSw: | -3.3215 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.497 |
| InChI Key: | WPQYUGBEHVLXTR-UHFFFAOYSA-N |