Home Other Building Blocks Edg-2 Receptor Inhibitor 1

Edg-2 Receptor Inhibitor 1

CAS No.:
1195941-38-8
Catalog Number:
AG01C6HJ
Molecular Formula:
C27H27NO5
Molecular Weight:
445.5070
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$223
- +
5mg
99%
1 week
United States
$543
- +
10mg
99%
1 week
United States
$821
- +
Product Description
Catalog Number:
AG01C6HJ
Chemical Name:
Edg-2 Receptor Inhibitor 1
CAS Number:
1195941-38-8
Molecular Formula:
C27H27NO5
Molecular Weight:
445.5070
MDL Number:
MFCD26406005
IUPAC Name:
2-[[4-methoxy-3-[2-(3-methylphenyl)ethoxy]benzoyl]amino]-1,3-dihydroindene-2-carboxylic acid
InChI:
InChI=1S/C27H27NO5/c1-18-6-5-7-19(14-18)12-13-33-24-15-20(10-11-23(24)32-2)25(29)28-27(26(30)31)16-21-8-3-4-9-22(21)17-27/h3-11,14-15H,12-13,16-17H2,1-2H3,(H,28,29)(H,30,31)
InChI Key:
SOJDTNUCCXWTMG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCc1cccc(c1)C)C(=O)NC1(Cc2c(C1)cccc2)C(=O)O
UNII:
Y76WZ464EY
Properties
Complexity:
667  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.189g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
445.515g/mol
Monoisotopic Mass:
445.189g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Properties