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Home Other Building Blocks Ono-7300243

Ono-7300243

CAS No.:
638132-34-0
Catalog Number:
AG00ELOI
Molecular Formula:
C28H31NO5
Molecular Weight:
461.5494
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$101
- +
5mg
98%
1 week
United States
$240
- +
10mg
98%
1 week
United States
$373
- +
25mg
98%
1 week
United States
$723
- +
50mg
98%
1 week
United States
$1257
- +
Product Description
Catalog Number:
AG00ELOI
Chemical Name:
Ono-7300243
CAS Number:
638132-34-0
Molecular Formula:
C28H31NO5
Molecular Weight:
461.5494
MDL Number:
MFCD30534399
IUPAC Name:
2-[4-[[(3,5-dimethoxy-4-methylbenzoyl)-(3-phenylpropyl)amino]methyl]phenyl]acetic acid
InChI:
InChI=1S/C28H31NO5/c1-20-25(33-2)17-24(18-26(20)34-3)28(32)29(15-7-10-21-8-5-4-6-9-21)19-23-13-11-22(12-14-23)16-27(30)31/h4-6,8-9,11-14,17-18H,7,10,15-16,19H2,1-3H3,(H,30,31)
InChI Key:
WGABOZPQOOZAOI-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1C)OC)C(=O)N(Cc1ccc(cc1)CC(=O)O)CCCc1ccccc1
Properties
Complexity:
612  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
461.22g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
461.558g/mol
Monoisotopic Mass:
461.22g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Literature
Title Journal
Discovery of ONO-7300243 from a Novel Class of Lysophosphatidic Acid Receptor 1 Antagonists: From Hit to Lead. ACS medicinal chemistry letters 20161013
Properties