N-[4-(dimethylamino)-3-({(4-fluorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-({(4-fluorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl]-3,3-dimethylbutanamide
N-[4-(dimethylamino)-3-({(4-fluorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V025-9898 |
| Compound Name: | N-[4-(dimethylamino)-3-({(4-fluorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 529.65 |
| Molecular Formula: | C28 H33 F2 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(Cc2ccc(cc2)F)S(c2ccc(cc2)F)(=O)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1018 |
| logD: | 6.1001 |
| logSw: | -5.5071 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.995 |
| InChI Key: | DEFUYGHRCLNMRZ-UHFFFAOYSA-N |