N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5,5-trimethylhexanamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5,5-trimethylhexanamide
N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5,5-trimethylhexanamide
Compound characteristics
| Compound ID: | V001-0455 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5,5-trimethylhexanamide |
| Molecular Weight: | 490.68 |
| Molecular Formula: | C27 H39 F N2 O3 S |
| Smiles: | CC(CC(N(CCOC)CC(N(Cc1ccc(cc1)F)Cc1c(C)ccs1)=O)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2195 |
| logD: | 5.2195 |
| logSw: | -4.9873 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.216 |
| InChI Key: | NGEGPCQNDMVGPI-HXUWFJFHSA-N |