N-(3-chlorophenyl)-2-({4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}methyl)morpholine-4-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-({4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}methyl)morpholine-4-carboxamide
N-(3-chlorophenyl)-2-({4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}methyl)morpholine-4-carboxamide
Compound characteristics
Compound ID: | V012-5516 |
Compound Name: | N-(3-chlorophenyl)-2-({4-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-1-yl}methyl)morpholine-4-carboxamide |
Molecular Weight: | 524.97 |
Molecular Formula: | C25 H28 Cl F3 N4 O3 |
Salt: | not_available |
Smiles: | C1CN(CCN(C1)C(c1ccc(cc1)C(F)(F)F)=O)CC1CN(CCO1)C(Nc1cccc(c1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8302 |
logD: | 3.8003 |
logSw: | -4.3391 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.257 |
InChI Key: | RYEPUSIOLRMPRO-QFIPXVFZSA-N |