CAS 137173-46-7 | Dodecanamide, N-[(3S)-tetrahydro-2-oxo-3-furanyl]- | CAS Number 137173-46-7

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137173-46-7 | Dodecanamide, N-[(3S)-tetrahydro-2-oxo-3-furanyl]-

CAS No: 137173-46-7 Catalog No: AG0012W7 MDL No:MFCD11976890

Product Description

Catalog Number:

AG0012W7

Chemical Name:

Dodecanamide, N-[(3S)-tetrahydro-2-oxo-3-furanyl]-

CAS Number:

137173-46-7

Molecular Formula:

C16H29NO3

Molecular Weight:

283.4064

MDL Number:

MFCD11976890

IUPAC Name:

N-[(3S)-2-oxooxolan-3-yl]dodecanamide

InChI:

InChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18)/t14-/m0/s1

InChI Key:

WILLZMOKUUPJSL-AWEZNQCLSA-N

SMILES:

CCCCCCCCCCCC(=O)N[C@H]1CCOC1=O

Properties

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.215g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.412g/mol

Monoisotopic Mass:

283.215g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8

Literature

Title	Journal
Substituted lactam and cyclic azahemiacetals modulate Pseudomonas aeruginosa quorum sensing.	Bioorganic & medicinal chemistry 20110915
Medicinal chemistry as a conduit for the modulation of quorum sensing.	Journal of medicinal chemistry 20101111
Synthesis of Pseudomonas quorum-sensing autoinducer analogs and structural entities required for induction of apoptosis in macrophages.	Bioorganic & medicinal chemistry letters 20060415
Synthetic analogues of the bacterial signal (quorum sensing) molecule N-(3-oxododecanoyl)-L-homoserine lactone as immune modulators.	Journal of medicinal chemistry 20030102