N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]-beta-alaninamide
N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]-beta-alaninamide
Compound characteristics
| Compound ID: | C464-1473 |
| Compound Name: | N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]-beta-alaninamide |
| Molecular Weight: | 485.48 |
| Molecular Formula: | C21 H22 F3 N3 O5 S |
| Smiles: | CCC(N1CCc2cc(ccc12)S(NCCC(Nc1ccc(cc1)OC(F)(F)F)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7001 |
| logD: | 3.7 |
| logSw: | -4.106 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.347 |
| InChI Key: | DFSKPFLKRLLIBH-UHFFFAOYSA-N |