2-({(3-methylbutyl)[(5-methylthiophen-2-yl)methyl]amino}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({(3-methylbutyl)[(5-methylthiophen-2-yl)methyl]amino}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
2-({(3-methylbutyl)[(5-methylthiophen-2-yl)methyl]amino}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V028-2005 |
| Compound Name: | 2-({(3-methylbutyl)[(5-methylthiophen-2-yl)methyl]amino}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 495.63 |
| Molecular Formula: | C24 H28 F3 N3 O S2 |
| Salt: | not_available |
| Smiles: | CC(C)CCN(Cc1ccc(C)s1)Cc1nc(cs1)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4392 |
| logD: | 6.4353 |
| logSw: | -5.7449 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.861 |
| InChI Key: | QRTLHXKKSPULLR-UHFFFAOYSA-N |