N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-3,5-bis(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-3,5-bis(trifluoromethyl)benzamide
N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-3,5-bis(trifluoromethyl)benzamide
Compound characteristics
Compound ID: | V008-3752 |
Compound Name: | N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-3,5-bis(trifluoromethyl)benzamide |
Molecular Weight: | 677.66 |
Molecular Formula: | C35 H34 F7 N3 O3 |
Smiles: | CCOCCCN(CC(N(Cc1ccccc1)Cc1cccn1Cc1ccc(cc1)F)=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 6.5014 |
logD: | 6.5014 |
logSw: | -5.6301 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.159 |
InChI Key: | ROIGMUAGJFAHOY-UHFFFAOYSA-N |