Products for Research Use Only
RegisterLogin

AZD1386

CAT: 0013-GTR19211608-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19211608-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
AZD1386
CAS Number
946080-23-5
Smiles
O=C1C2 (C=3C (N1CC4=CC (C (F) (F) F) =CC=C4) =C (C) C=C (Cl) C3) NC (=O) NC2=O
Molecular Formula
C19H13ClF3N3O3
Molecular Weight
423.77
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5'-Chloro-7'-methyl-1'-[[3-(trifluoromethyl)phenyl]methyl]-spiro[imidazolidine-4,3'-[3H]indole]-2,2',5(1'H)-trione
CAS Number946080-23-5
PubChem CID24752296
IUPAC Name5'-chloro-7'-methyl-1'-[[3-(trifluoromethyl)phenyl]methyl]spiro[imidazolidine-5,3'-indole]-2,2',4-trione
Molecular FormulaC19H13ClF3N3O3
Molecular Weight423.8
XLogP3.2
Topological Polar Surface Area78.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count29
Formal Charge0
Complexity733
SMILES
CC1=CC(=CC2=C1N(C(=O)C23C(=O)NC(=O)N3)CC4=CC(=CC=C4)C(F)(F)F)Cl
InChI
InChI=1S/C19H13ClF3N3O3/c1-9-5-12(20)7-13-14(9)26(16(28)18(13)15(27)24-17(29)25-18)8-10-3-2-4-11(6-10)19(21,22)23/h2-7H,8H2,1H3,(H2,24,25,27,29)
InChIKey
DXDVSYALLVVBOV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5'-Chloro-7'-methyl-1'-[[3-(trifluoromethyl)phenyl]methyl]-spiro[imidazolidine-4,3'-[3H]indole]-2,2',5(1'H)-trione
CAS: 946080-23-5
CID: 24752296
Formula: C19H13ClF3N3O3
MW: 423.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight423.8
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass423.0597535
Monoisotopic Mass423.0597535
Topological Polar Surface Area78.5 Ų
Heavy Atom Count29
Formal Charge0
Complexity733
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19213725-01AZD8186
GTR19259418-01AZD2389
GTR19177801-01AZD1080
GTR19162814-01AZD1390
GTR19161245-01AZD1080
GTR19160242-01AZD1981
GTR19171882-01AZD1981
GTR19160182-01AZD1283
GTR19258720-01AZD2389
GTR19168094-01AZD8186

Alternative Products

CatalogName
T68271-01AZD1386

Popular Products