N-[4-(dimethylamino)-3-{[(3-fluorophenyl)-N-(2-methoxyethyl)carbamamido]methyl}phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-{[(3-fluorophenyl)-N-(2-methoxyethyl)carbamamido]methyl}phenyl]-3,3-dimethylbutanamide
N-[4-(dimethylamino)-3-{[(3-fluorophenyl)-N-(2-methoxyethyl)carbamamido]methyl}phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V024-4195 |
| Compound Name: | N-[4-(dimethylamino)-3-{[(3-fluorophenyl)-N-(2-methoxyethyl)carbamamido]methyl}phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C25 H35 F N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(CCOC)C(Nc2cccc(c2)F)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7424 |
| logD: | 4.7277 |
| logSw: | -4.5867 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.244 |
| InChI Key: | AQOOPELZEWZKIZ-UHFFFAOYSA-N |