ethyl 6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-5-hydroxy-4-[(morpholin-4-yl)methyl]-1-phenyl-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-5-hydroxy-4-[(morpholin-4-yl)methyl]-1-phenyl-1H-indole-3-carboxylate
ethyl 6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-5-hydroxy-4-[(morpholin-4-yl)methyl]-1-phenyl-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8015-9975 |
| Compound Name: | ethyl 6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-5-hydroxy-4-[(morpholin-4-yl)methyl]-1-phenyl-1H-indole-3-carboxylate |
| Molecular Weight: | 596.52 |
| Molecular Formula: | C29 H34 Br N5 O4 |
| Smiles: | CCOC(c1c2c(CN3CCOCC3)c(c(cc2n(c2ccccc2)c1CN1CCN(CC1)CC#N)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9282 |
| logD: | 2.8177 |
| logSw: | -3.2971 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.581 |
| InChI Key: | YYOMHEYRWAXSCP-UHFFFAOYSA-N |