2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-butyl-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-butyl-1,3-thiazole-4-carboxamide
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-butyl-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V006-5915 |
| Compound Name: | 2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[3-(trifluoromethyl)phenyl]methyl}amino)methyl]-N-butyl-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 505.56 |
| Molecular Formula: | C25 H26 F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCCCNC(c1csc(CN(Cc2cccc(c2)C(F)(F)F)Cc2ccc3c(c2)OCO3)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5112 |
| logD: | 5.5111 |
| logSw: | -5.3614 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.821 |
| InChI Key: | ZESOJIKTIRYUJD-UHFFFAOYSA-N |