Synonyms
(S)-N-((4-dodecylphenyl)sulfonyl)pyrrolidine-2-carboxamide;1068139-38-7;SCHEMBL3486366;
IUPAC Name
N-(4-dodecylphenyl)sulfonylpyrrolidine-2-carboxamide;
Molecular Weight
422.628g/mol
Molecular Formula
C23H38N2O3S;
Canonical SMILES
CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2CCCN2;
InChI
InChI=1S/C23H38N2O3S/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-21(18-16-20)29(27,28)25-23(26)22-14-12-19-24-22/h15-18,22,24H,2-14,19H2,1H3,(H,25,26);
InChI Key
FAGYODAJNLXMRF-UHFFFAOYSA-N;
Complexity
551
Covalently-Bonded Unit Count
1
Exact Mass
422.26g/mol
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
29
Monoisotopic Mass
422.26g/mol
Rotatable Bond Count
14
Topological Polar Surface Area
83.6A^2
Undefined Atom Stereocenter Count
1
