N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(propan-2-yl)phenyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(propan-2-yl)phenyl]-beta-alaninamide
N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(propan-2-yl)phenyl]-beta-alaninamide
Compound characteristics
Compound ID: | C464-1417 |
Compound Name: | N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[4-(propan-2-yl)phenyl]-beta-alaninamide |
Molecular Weight: | 443.56 |
Molecular Formula: | C23 H29 N3 O4 S |
Smiles: | CCC(N1CCc2cc(ccc12)S(NCCC(Nc1ccc(cc1)C(C)C)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8471 |
logD: | 3.847 |
logSw: | -3.9641 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.41 |
InChI Key: | UVZWIIWTFORLJJ-UHFFFAOYSA-N |