N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
Chemical Structure Depiction of
N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
Compound characteristics
| Compound ID: | D050-0092 |
| Compound Name: | N-(1,2-benzoxazol-3-yl)-5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide |
| Molecular Weight: | 450.31 |
| Molecular Formula: | C18 H16 Br N3 O4 S |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(Nc1c2ccccc2on1)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.686 |
| logD: | 2.0515 |
| logSw: | -4.0069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.379 |
| InChI Key: | RHCGJDJAYZEFKE-UHFFFAOYSA-N |