Products for Research Use Only
RegisterLogin

GSK2850163

CAT: 0607-BA4210-100Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-BA4210-100Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2121989-91-9
Form
An oil
Molecular Formula
C24H29Cl2N3O
Molecular Weight
446.41
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Gsk2850163
CAS Number2121989-91-9
PubChem CID73291790
IUPAC Name(5R)-2-[(3,4-dichlorophenyl)methyl]-N-[(4-methylphenyl)methyl]-2,7-diazaspiro[4.5]decane-7-carboxamide
Molecular FormulaC24H29Cl2N3O
Molecular Weight446.4
XLogP4.9
Topological Polar Surface Area35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity583
SMILES
CC1=CC=C(C=C1)CNC(=O)N2CCC[C@@]3(C2)CCN(C3)CC4=CC(=C(C=C4)Cl)Cl
InChI
InChI=1S/C24H29Cl2N3O/c1-18-3-5-19(6-4-18)14-27-23(30)29-11-2-9-24(17-29)10-12-28(16-24)15-20-7-8-21(25)22(26)13-20/h3-8,13H,2,9-12,14-17H2,1H3,(H,27,30)/t24-/m1/s1
InChIKey
YFDASBFQKMHSSJ-XMMPIXPASA-N
Chemical Structure
2D Structure
2D structure of Gsk2850163
CAS: 2121989-91-9
CID: 73291790
Formula: C24H29Cl2N3O
MW: 446.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight446.4
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass445.1687679
Monoisotopic Mass445.1687679
Topological Polar Surface Area35.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity583
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

Alternative Products

CatalogName
MBS3614880-01GSK2850163
T63198-01GSK2850163 hydrochloride
HY-U00459BGSK2850163 (hydrochloride)
MBS5825401GSK2850163 (S enantiomer)
T11489-01GSK2850163 S enantiomer
T11488L-01GSK2850163 hydrochloride (2121989-91-9 free base)

Popular Products