N-(4-benzyl-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(4-benzyl-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide
N-(4-benzyl-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V004-3158 |
| Compound Name: | N-(4-benzyl-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 454.45 |
| Molecular Formula: | C25 H21 F3 N2 O3 |
| Smiles: | CC1C(N(Cc2ccccc2)Cc2cc(ccc2O1)NC(c1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6861 |
| logD: | 4.6855 |
| logSw: | -4.5298 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.672 |
| InChI Key: | HILABSSJVQDFMD-MRXNPFEDSA-N |