methyl 2-{[4-(1-methyl-1H-indole-5-sulfonyl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(1-methyl-1H-indole-5-sulfonyl)piperazine-1-carbonyl]amino}benzoate
methyl 2-{[4-(1-methyl-1H-indole-5-sulfonyl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G589-0096 |
| Compound Name: | methyl 2-{[4-(1-methyl-1H-indole-5-sulfonyl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | Cn1ccc2cc(ccc12)S(N1CCN(CC1)C(Nc1ccccc1C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.851 |
| logD: | 2.8502 |
| logSw: | -3.4894 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.369 |
| InChI Key: | MMIWTRAXXRZYSO-UHFFFAOYSA-N |