N-benzyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-benzyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}thiophene-2-carboxamide
N-benzyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V003-3433 |
| Compound Name: | N-benzyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(CN(Cc2ccccc2)C(c2cccs2)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3685 |
| logD: | 5.3541 |
| logSw: | -5.317 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.849 |
| InChI Key: | AGQUYYHPDVXWNM-UHFFFAOYSA-N |