2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N-[(4-fluorophenyl)methyl]acetamide
2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
Compound ID: | E587-0445 |
Compound Name: | 2-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)-N-[(4-fluorophenyl)methyl]acetamide |
Molecular Weight: | 453.58 |
Molecular Formula: | C25 H28 F N3 O2 S |
Smiles: | C1CCCN(CC1)C(Cn1cc(c2ccccc12)SCC(NCc1ccc(cc1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7403 |
logD: | 3.7403 |
logSw: | -3.83 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.894 |
InChI Key: | JUJOVKIYBOINNH-UHFFFAOYSA-N |