Home Aminos 1-(Diallylamino)-3-(2,3-dimethyl-1H-indol-1-yl)propan-2-ol

1-(Diallylamino)-3-(2,3-dimethyl-1H-indol-1-yl)propan-2-ol

CAS No.:
315247-81-5
Catalog Number:
AG007J09
Molecular Formula:
C19H26N2O
Molecular Weight:
298.4225
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Purity
Availability
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Price(USD)
Quantity
  
1g
95%
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United States
$64
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Product Description
Catalog Number:
AG007J09
Chemical Name:
1-(Diallylamino)-3-(2,3-dimethyl-1H-indol-1-yl)propan-2-ol
CAS Number:
315247-81-5
Molecular Formula:
C19H26N2O
Molecular Weight:
298.4225
MDL Number:
MFCD02157450
IUPAC Name:
1-[bis(prop-2-enyl)amino]-3-(2,3-dimethylindol-1-yl)propan-2-ol
InChI:
InChI=1S/C19H26N2O/c1-5-11-20(12-6-2)13-17(22)14-21-16(4)15(3)18-9-7-8-10-19(18)21/h5-10,17,22H,1-2,11-14H2,3-4H3
InChI Key:
CROAQSSVNDOJAZ-UHFFFAOYSA-N
SMILES:
C=CCN(CC(Cn1c2ccccc2c(c1C)C)O)CC=C
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.205g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
298.43g/mol
Monoisotopic Mass:
298.205g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
28.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties