methyl 1-butyl-2-methyl-4-(3-methylbutanamido)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-butyl-2-methyl-4-(3-methylbutanamido)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-butyl-2-methyl-4-(3-methylbutanamido)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | 8602-0374 |
Compound Name: | methyl 1-butyl-2-methyl-4-(3-methylbutanamido)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate |
Molecular Weight: | 378.39 |
Molecular Formula: | C17 H25 F3 N2 O4 |
Smiles: | CCCCN1C(C)=C(C(=O)OC)C(C1=O)(C(F)(F)F)NC(CC(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1116 |
logD: | 0.4787 |
logSw: | -3.0713 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.455 |
InChI Key: | DULBTAXYEZYNKC-INIZCTEOSA-N |