Products for Research Use Only
RegisterLogin

CCR2 antagonist 1 1mg

CAT: 0628-A19318-1Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A19318-1Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1683534-96-4

Chemical Information

CCR2 antagonist 1
CAS Number1683534-96-4
PubChem CID73334813
IUPAC Name[(1S,3R)-3-[[(1R)-5-bromo-2,3-dihydro-1H-inden-1-yl]amino]-1-propan-2-ylcyclopentyl]-[7-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone
Molecular FormulaC28H32BrF3N2O
Molecular Weight549.5
XLogP6.4
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count35
Formal Charge0
Complexity776
SMILES
CC(C)[C@@]1(CC[C@H](C1)N[C@@H]2CCC3=C2C=CC(=C3)Br)C(=O)N4CCC5=C(C4)C=C(C=C5)C(F)(F)F
InChI
InChI=1S/C28H32BrF3N2O/c1-17(2)27(11-9-23(15-27)33-25-8-4-19-14-22(29)6-7-24(19)25)26(35)34-12-10-18-3-5-21(28(30,31)32)13-20(18)16-34/h3,5-7,13-14,17,23,25,33H,4,8-12,15-16H2,1-2H3/t23-,25-,27+/m1/s1
InChIKey
QYDUEIJZRKTNKN-HYZYYIOASA-N
Chemical Structure
2D Structure
2D structure of CCR2 antagonist 1
CAS: 1683534-96-4
CID: 73334813
Formula: C28H32BrF3N2O
MW: 549.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight549.5
XLogP36.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass548.16501
Monoisotopic Mass548.16501
Topological Polar Surface Area32.3 Ų
Heavy Atom Count35
Formal Charge0
Complexity776
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
A20467-1CCR2 antagonist 3 1mg
A19318-25CCR2 antagonist 1 25mg
A19318-10CCR2 antagonist 1 10mg
A19318-50CCR2 antagonist 1 50mg
A19318-100CCR2 antagonist 1 100mg
A19318-5CCR2 antagonist 1 5mg
A20439-1CCR5 antagonist 1 1mg
A20467-50CCR2 antagonist 3 50mg
A20467-100CCR2 antagonist 3 100mg
A20467-25CCR2 antagonist 3 25mg

Alternative Products

CatalogName
sc-202525CCR2 Antagonist
HY-101264-01CCR2 antagonist 3
MBS3843775-01CCR2 antagonist 1
MBS5754028CCR2 antagonist 4
T27682-01CCR2 antagonist 5

Popular Products