N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)piperidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C259-1098 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 578.48 |
| Molecular Formula: | C25 H28 Br N3 O6 S |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(N1CCCC(C1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9523 |
| logD: | 2.9523 |
| logSw: | -3.5667 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.835 |
| InChI Key: | FSYGSVCEZZQUJL-SFHVURJKSA-N |