N-[(4-methoxyphenyl)methyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
N-[(4-methoxyphenyl)methyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | C464-1332 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | CCC(N1CCc2cc(ccc12)S(NCCC(NCc1ccc(cc1)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1915 |
| logD: | 2.1914 |
| logSw: | -2.8762 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.276 |
| InChI Key: | YLYVOJMXQRPTKZ-UHFFFAOYSA-N |