N-[4-(dimethylamino)-3-({2-ethyl-N-[(3-fluorophenyl)methyl]butanamido}methyl)phenyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-({2-ethyl-N-[(3-fluorophenyl)methyl]butanamido}methyl)phenyl]thiophene-2-carboxamide
N-[4-(dimethylamino)-3-({2-ethyl-N-[(3-fluorophenyl)methyl]butanamido}methyl)phenyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V012-8865 |
| Compound Name: | N-[4-(dimethylamino)-3-({2-ethyl-N-[(3-fluorophenyl)methyl]butanamido}methyl)phenyl]thiophene-2-carboxamide |
| Molecular Weight: | 481.63 |
| Molecular Formula: | C27 H32 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CCC(CC)C(N(Cc1cccc(c1)F)Cc1cc(ccc1N(C)C)NC(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0017 |
| logD: | 5.9994 |
| logSw: | -5.5174 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.063 |
| InChI Key: | WHXJYKKJZTUFNH-UHFFFAOYSA-N |