butyl 4-{[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
butyl 4-{[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]amino}benzoate
butyl 4-{[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D256-0428 |
| Compound Name: | butyl 4-{[1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-indole-5-carbonyl]amino}benzoate |
| Molecular Weight: | 492.59 |
| Molecular Formula: | C27 H28 N2 O5 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(c1ccc2c(CCN2S(c2ccc(C)cc2)(=O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.971 |
| logD: | 5.9534 |
| logSw: | -5.3481 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.896 |
| InChI Key: | KPPKYLVJSACQOJ-UHFFFAOYSA-N |