methyl 4-[3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)propanamido]benzoate
methyl 4-[3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)propanamido]benzoate
Compound characteristics
| Compound ID: | E699-2700 |
| Compound Name: | methyl 4-[3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)propanamido]benzoate |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C21 H22 N2 O6 S |
| Smiles: | CC(N1CCc2cc(ccc12)S(CCC(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7398 |
| logD: | 1.7389 |
| logSw: | -2.5747 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.745 |
| InChI Key: | KUKXPFOUJROXMI-UHFFFAOYSA-N |