Products for Research Use Only
RegisterLogin

(R) -IDO/TDO-IN-1

CAT: 0931-T84728-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T84728-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2033173-00-9
Target
Others, IDO, Indoleamine 2,3-Dioxygenase (IDO)
Related Pathways
Metabolism, Others
Bioactivity
(R) -IDO/TDO-IN-1 (compound 25), an indoleamine-2,3-dioxygenase (IDO) inhibitor, demonstrates good pharmacokinetic properties and exerts anti-tumor effects in the MC38 xenograft model. This compound exhibits synergy when combined with the anti-PD-1 monoclonal antibody (SHR-1210) [1].
Smiles
FC1=C2[C@H](N3C(C2=CC=C1)=CN=C3)C4CCN(CC4)C5=CC=C(C=C5)C6=CN(C)N=C6
Molecular Formula
C25H24FN5
Molecular Weight
413.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(R)-Ido/tdo-IN-1
CAS Number2033173-00-9
PubChem CID122650368
IUPAC Name(5R)-6-fluoro-5-[1-[4-(1-methylpyrazol-4-yl)phenyl]piperidin-4-yl]-5H-imidazo[5,1-a]isoindole
Molecular FormulaC25H24FN5
Molecular Weight413.5
XLogP4
Topological Polar Surface Area38.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity617
SMILES
CN1C=C(C=N1)C2=CC=C(C=C2)N3CCC(CC3)[C@@H]4C5=C(C=CC=C5F)C6=CN=CN46
InChI
InChI=1S/C25H24FN5/c1-29-15-19(13-28-29)17-5-7-20(8-6-17)30-11-9-18(10-12-30)25-24-21(3-2-4-22(24)26)23-14-27-16-31(23)25/h2-8,13-16,18,25H,9-12H2,1H3/t25-/m1/s1
InChIKey
UJGQDAMZVUNFBQ-RUZDIDTESA-N
Chemical Structure
2D Structure
2D structure of (R)-Ido/tdo-IN-1
CAS: 2033173-00-9
CID: 122650368
Formula: C25H24FN5
MW: 413.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight413.5
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass413.20157395
Monoisotopic Mass413.20157395
Topological Polar Surface Area38.9 Ų
Heavy Atom Count31
Formal Charge0
Complexity617
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T11623-01IDO/TDO-IN-1
T61385-01IDO1/TDO-IN-1
T61202-01TDO-IN-1
T211673-01IDO1/TDO-IN-9
T60318-01IDO1/TDO-IN-4
T78795-01IDO1/TDO-IN-6
T200785-01IDO1/TDO-IN-7
T207127-01IDO1/TDO-IN-8
T60499-01IDO1/TDO-IN-2
T61140-01IDO1/TDO-IN-3

Alternative Products

CatalogName
MBS5766840IDO/TDO-IN-1
A18566-25IDO/TDO-IN-1 25mg
A18566-10IDO/TDO-IN-1 10mg
A18566-5IDO/TDO-IN-1 5mg
GTR19232596-01(R) -IDO/TDO-IN-1
A18566-100IDO/TDO-IN-1 100mg
A18566-50IDO/TDO-IN-1 50mg
HY-151425-01TDO-IN-1
MBS5804089IDO1/TDO-IN-1
C3211-5IDO-IN-1

Popular Products