N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | C183-0273 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propanamide |
| Molecular Weight: | 523.4 |
| Molecular Formula: | C22 H23 Br N2 O6 S |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(CCC(NCc1ccc2c(c1)OCO2)=O)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8418 |
| logD: | 2.8418 |
| logSw: | -3.5264 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.013 |
| InChI Key: | PMZBJLBAARHUPC-UHFFFAOYSA-N |