ethyl 2-(N-cyclopentyl-4-nitrobenzamido)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(N-cyclopentyl-4-nitrobenzamido)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
ethyl 2-(N-cyclopentyl-4-nitrobenzamido)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | Y501-1359 |
Compound Name: | ethyl 2-(N-cyclopentyl-4-nitrobenzamido)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate |
Molecular Weight: | 457.43 |
Molecular Formula: | C19 H18 F3 N3 O5 S |
Smiles: | CCOC(c1c(C(F)(F)F)nc(N(C2CCCC2)C(c2ccc(cc2)[N+]([O-])=O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 4.8057 |
logD: | 4.8057 |
logSw: | -4.6215 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 80.034 |
InChI Key: | OPFHAMWPJLFOOF-UHFFFAOYSA-N |