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CAS 1212404-61-9

:

rel-1,1-Dimethylethyl N-[(3R,4S)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolidinyl]carbamate

Description:
Rel-1,1-Dimethylethyl N-[(3R,4S)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolidinyl]carbamate, with CAS number 1212404-61-9, is a chemical compound characterized by its complex structure, which includes a carbamate functional group and a pyrrolidine ring. This compound features a trifluoromethyl-substituted phenyl group, contributing to its unique electronic properties and potential biological activity. The stereochemistry indicated by the (3R,4S) configuration suggests specific spatial arrangements that may influence its interaction with biological targets, making it of interest in medicinal chemistry. The presence of the dimethylethyl group enhances its lipophilicity, potentially affecting its solubility and permeability in biological systems. Such characteristics may render it suitable for applications in pharmaceuticals, particularly in the development of drugs targeting specific receptors or enzymes. Overall, the compound's structural features suggest it may exhibit significant pharmacological properties, warranting further investigation into its efficacy and safety in therapeutic contexts.
Formula:C16H21F3N2O2
InChI:InChI=1/C16H21F3N2O2/c1-15(2,3)23-14(22)21-13-9-20-8-12(13)10-4-6-11(7-5-10)16(17,18)19/h4-7,12-13,20H,8-9H2,1-3H3,(H,21,22)/t12-,13+/s2
InChI key:InChIKey=TZTDXEAWMSGECI-QWAQRTLVNA-N
SMILES:N(C(OC(C)(C)C)=O)[C@H]1[C@@H](CNC1)C2=CC=C(C(F)(F)F)C=C2
Synonyms:
  • rel-1,1-Dimethylethyl N-[(3R,4S)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolidinyl]carbamate
  • Carbamic acid, N-[(3R,4S)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolidinyl]-, 1,1-dimethylethyl ester, rel-
  • TZTDXEAWMSGECI-OLZOCXBDSA-N
  • tert-Butyl (trans-4-(4-(trifluoromethyl)phenyl)pyrrolidin-3-yl)carbamate
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