Home Other Building Blocks Incb 3284

Incb 3284

CAS No.:
887401-92-5
Catalog Number:
AG00GU8L
Molecular Formula:
C26H31F3N4O4
Molecular Weight:
520.5439
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
99%
1 week
United States
$210
- +
50mg
99%
1 week
United States
$773
- +
Product Description
Catalog Number:
AG00GU8L
Chemical Name:
Incb 3284
CAS Number:
887401-92-5
Molecular Formula:
C26H31F3N4O4
Molecular Weight:
520.5439
MDL Number:
MFCD28386146
IUPAC Name:
N-[2-[[(3R)-1-[4-hydroxy-4-(6-methoxypyridin-3-yl)cyclohexyl]pyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide
InChI:
InChI=1S/C26H31F3N4O4/c1-37-23-6-5-19(14-30-23)25(36)10-7-21(8-11-25)33-12-9-20(16-33)32-22(34)15-31-24(35)17-3-2-4-18(13-17)26(27,28)29/h2-6,13-14,20-21,36H,7-12,15-16H2,1H3,(H,31,35)(H,32,34)/t20-,21?,25?/m1/s1
InChI Key:
NXZNYBUBXWWKCP-JMOWIOHXSA-N
SMILES:
COc1ccc(cn1)[C@]1(O)CC[C@H](CC1)N1CC[C@H](C1)NC(=O)CNC(=O)c1cccc(c1)C(F)(F)F
UNII:
0W6K09GAQB
Properties
Complexity:
790  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
520.23g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
520.553g/mol
Monoisotopic Mass:
520.23g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Literature
Title Journal
Discovery of INCB8761/PF-4136309, a Potent, Selective, and Orally Bioavailable CCR2 Antagonist. ACS medicinal chemistry letters 20111208
Discovery of INCB3284, a Potent, Selective, and Orally Bioavailable hCCR2 Antagonist. ACS medicinal chemistry letters 20110609
Properties