2-{[6-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-6-oxohexyl]carbamoyl}benzoic acid
Chemical Structure Depiction of
2-{[6-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-6-oxohexyl]carbamoyl}benzoic acid
2-{[6-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-6-oxohexyl]carbamoyl}benzoic acid
Compound characteristics
| Compound ID: | 8012-9913 |
| Compound Name: | 2-{[6-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-6-oxohexyl]carbamoyl}benzoic acid |
| Molecular Weight: | 541.65 |
| Molecular Formula: | C32 H35 N3 O5 |
| Smiles: | Cc1c(CCNC(CCCCCNC(c2ccccc2C(O)=O)=O)=O)c2cc(ccc2[nH]1)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9898 |
| logD: | -0.0398 |
| logSw: | -4.3472 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.368 |
| InChI Key: | MTWYFDZQPIGREN-UHFFFAOYSA-N |