N-[4-(diethylamino)-2-methylphenyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
N-[4-(diethylamino)-2-methylphenyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | C464-1485 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C25 H34 N4 O4 S |
| Smiles: | CCC(N1CCc2cc(ccc12)S(NCCC(Nc1ccc(cc1C)N(CC)CC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2861 |
| logD: | 3.0767 |
| logSw: | -3.6828 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.449 |
| InChI Key: | NYZGPFMRWIFHHS-UHFFFAOYSA-N |