N-[4-(dimethylamino)-3-({[(4-fluorophenyl)methyl](methanesulfonyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-({[(4-fluorophenyl)methyl](methanesulfonyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
N-[4-(dimethylamino)-3-({[(4-fluorophenyl)methyl](methanesulfonyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V028-0820 |
| Compound Name: | N-[4-(dimethylamino)-3-({[(4-fluorophenyl)methyl](methanesulfonyl)amino}methyl)phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C23 H32 F N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(Cc2ccc(cc2)F)S(C)(=O)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4056 |
| logD: | 4.4041 |
| logSw: | -4.3149 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.759 |
| InChI Key: | VESSZAWVOSVMGQ-UHFFFAOYSA-N |