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Home Other Building Blocks Alw-ii-41-27

Alw-ii-41-27

CAS No.:
1186206-79-0
Catalog Number:
AG008TDD
Molecular Formula:
C32H32F3N5O2S
Molecular Weight:
607.6890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$125
- +
5mg
99%
1 week
United States
$348
- +
10mg
99%
1 week
United States
$515
- +
50mg
99%
1 week
United States
$1432
- +
Product Description
Catalog Number:
AG008TDD
Chemical Name:
Alw-ii-41-27
CAS Number:
1186206-79-0
Molecular Formula:
C32H32F3N5O2S
Molecular Weight:
607.6890
MDL Number:
MFCD25372028
IUPAC Name:
N-[5-[[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]carbamoyl]-2-methylphenyl]-5-thiophen-2-ylpyridine-3-carboxamide
InChI:
InChI=1S/C32H32F3N5O2S/c1-3-39-10-12-40(13-11-39)20-23-8-9-26(17-27(23)32(33,34)35)37-30(41)22-7-6-21(2)28(16-22)38-31(42)25-15-24(18-36-19-25)29-5-4-14-43-29/h4-9,14-19H,3,10-13,20H2,1-2H3,(H,37,41)(H,38,42)
InChI Key:
HYWXBDQAYLPMIX-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)c1ccc(c(c1)NC(=O)c1cncc(c1)c1cccs1)C
Properties
Complexity:
933  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
607.223g/mol
Formal Charge:
0
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
607.696g/mol
Monoisotopic Mass:
607.223g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Literature
Title Journal
Discovery and structural analysis of Eph receptor tyrosine kinase inhibitors. Bioorganic & medicinal chemistry letters 20090801
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties