2-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-[4-(trifluoromethyl)benzamido]benzamide
Chemical Structure Depiction of
2-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-[4-(trifluoromethyl)benzamido]benzamide
2-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-[4-(trifluoromethyl)benzamido]benzamide
Compound characteristics
Compound ID: | V012-9856 |
Compound Name: | 2-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-[4-(trifluoromethyl)benzamido]benzamide |
Molecular Weight: | 558.64 |
Molecular Formula: | C30 H37 F3 N4 O3 |
Salt: | not_available |
Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(C1CCCC1)=O)NC(c1ccc(cc1)C(F)(F)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1856 |
logD: | 5.1852 |
logSw: | -5.059 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.758 |
InChI Key: | VMXKCPLHVMWFAA-UHFFFAOYSA-N |