Products for Research Use Only

PF-04363467 HCl

CAT: 0931-T69973-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T69973-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2040055-81-8
Target
Others
Related Pathways
Others
Bioactivity
PF-04363467 HCl is a selective dopamine D3/D2 receptor antagonist.
Smiles
CC=1C=C(C=CC1NS(=O)(=O)C2=CC=C(C(C)C)C=C2)[C@H]3CN(CC)CCO3
Molecular Formula
C22H30N2O3S
Molecular Weight
402.55
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(S)-N-(4-(4-Ethylmorpholin-2-yl)-2-methylphenyl)-4-isopropylbenzenesulfonamide
CAS Number2040055-81-8
PubChem CID99644814
IUPAC NameN-[4-[(2S)-4-ethylmorpholin-2-yl]-2-methylphenyl]-4-propan-2-ylbenzenesulfonamide
Molecular FormulaC22H30N2O3S
Molecular Weight402.6
XLogP3.8
Topological Polar Surface Area67
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity581
SMILES
CCN1CCO[C@H](C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)C)C
InChI
InChI=1S/C22H30N2O3S/c1-5-24-12-13-27-22(15-24)19-8-11-21(17(4)14-19)23-28(25,26)20-9-6-18(7-10-20)16(2)3/h6-11,14,16,22-23H,5,12-13,15H2,1-4H3/t22-/m1/s1
InChIKey
SVIVAENOUMHBBT-JOCHJYFZSA-N
Chemical Structure
2D Structure
2D structure of (S)-N-(4-(4-Ethylmorpholin-2-yl)-2-methylphenyl)-4-isopropylbenzenesulfonamide
CAS: 2040055-81-8
CID: 99644814
Formula: C22H30N2O3S
MW: 402.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight402.6
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass402.19771400
Monoisotopic Mass402.19771400
Topological Polar Surface Area67 Ų
Heavy Atom Count28
Formal Charge0
Complexity581
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