methyl 2-{[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]amino}benzoate
methyl 2-{[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E203-1102 |
| Compound Name: | methyl 2-{[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]amino}benzoate |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C22 H21 N3 O5 S |
| Smiles: | Cn1cc(cc1C(Nc1ccccc1C(=O)OC)=O)S(N1CCc2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9161 |
| logD: | 2.2884 |
| logSw: | -3.653 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.634 |
| InChI Key: | USNHSALSMYYDMJ-UHFFFAOYSA-N |