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Ralinepag

CAS No.:
1187856-49-0
Catalog Number:
AG008ZUR
Molecular Formula:
C23H26ClNO5
Molecular Weight:
431.9092
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$286
- +
10mg
98%
1 week
United States
$460
- +
50mg
98%
1 week
United States
$1515
- +
100mg
98%
1 week
United States
$2626
- +
Product Description
Catalog Number:
AG008ZUR
Chemical Name:
Ralinepag
CAS Number:
1187856-49-0
Molecular Formula:
C23H26ClNO5
Molecular Weight:
431.9092
MDL Number:
MFCD28502072
IUPAC Name:
2-[[4-[[(4-chlorophenyl)-phenylcarbamoyl]oxymethyl]cyclohexyl]methoxy]acetic acid
InChI:
InChI=1S/C23H26ClNO5/c24-19-10-12-21(13-11-19)25(20-4-2-1-3-5-20)23(28)30-15-18-8-6-17(7-9-18)14-29-16-22(26)27/h1-5,10-13,17-18H,6-9,14-16H2,(H,26,27)
InChI Key:
NPDKXVKJRHPDQT-UHFFFAOYSA-N
SMILES:
OC(=O)COC[C@@H]1CC[C@H](CC1)COC(=O)N(c1ccc(cc1)Cl)c1ccccc1
UNII:
CQY12ZJN6E
Properties
Complexity:
538  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.15g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
431.913g/mol
Monoisotopic Mass:
431.15g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties