Structure

Cur 61414

CAS
334998-36-6
Catalog Number
ACM334998366
Category
Other Products
Molecular Weight
550.69
Molecular Formula
C31H42N4O5

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Specification

Synonyms
N-[(3S,5S)-1-(1,3-Benzodioxol-5-ylmethyl)-5-(1-piperazinylcarbonyl)-3-pyrrolidinyl]-N-[(3-methoxyphenyl)methyl]-3,3-dimethylbutanamide;
IUPAC Name
N-[(3S,5S)-1-(1,3-benzodioxol-5-ylmethyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-[(3-methoxyphenyl)methyl]-3,3-dimethylbutanamide
Canonical SMILES
CC(C)(C)CC(=O)N(CC1=CC(=CC=C1)OC)C2CC(N(C2)CC3=CC4=C(C=C3)OCO4)C(=O)N5CCNCC5
InChI Key
WPHXYKUPFJRJDK-AHWVRZQESA-N
Boiling Point
703.51ºC at 760 mmHg
Flash Point
379.269ºC
Density
1.25g/cm³
Appearance
Pale Yellow Solid
Exact Mass
550.31600
H-Bond Acceptor
7
H-Bond Donor
1
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