N-butyl-2-({N-butyl[4-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-butyl-2-({N-butyl[4-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3-thiazole-4-carboxamide
N-butyl-2-({N-butyl[4-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V028-5886 |
| Compound Name: | N-butyl-2-({N-butyl[4-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 456.53 |
| Molecular Formula: | C21 H27 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCCNC(c1csc(CN(CCCC)C(Nc2ccc(cc2)C(F)(F)F)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4593 |
| logD: | 5.4593 |
| logSw: | -5.2464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.276 |
| InChI Key: | MYSZVWLKNIBUAI-UHFFFAOYSA-N |