2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V015-7609 |
| Compound Name: | 2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 518.56 |
| Molecular Formula: | C25 H25 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)C(F)(F)F)NC(c1csc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.856 |
| logD: | 2.6441 |
| logSw: | -4.1364 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.541 |
| InChI Key: | LEUJVDZLPLSWBN-UHFFFAOYSA-N |