Products for Research Use Only
RegisterLogin

PH-002

CAT: 0931-T16518-05Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T16518-05Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1311174-68-1
Target
Others
Related Pathways
Others
Purity
0.9936
Bioactivity
PH-002, an inhibitor targeting the intramolecular domain interaction of apolipoprotein (apo) E4 in neuronal cells, additionally enhances mitochondrial motility and promotes neurite outgrowth, thereby countering related impairments.
Smiles
Cn1nc(CC(=O)Nc2ccc(CN3CCN(CC3)C(=O)OC(C)(C)C)cc2)c2ccccc2c1=O
Molecular Formula
C27H33N5O4
Molecular Weight
491.58
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

tert-Butyl 4-(4-(2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido)benzyl)piperazine-1-carboxylate
CAS Number1311174-68-1
PubChem CID71451956
IUPAC Nametert-butyl 4-[[4-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]phenyl]methyl]piperazine-1-carboxylate
Molecular FormulaC27H33N5O4
Molecular Weight491.6
XLogP2.7
Topological Polar Surface Area94.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count36
Formal Charge0
Complexity838
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C
InChI
InChI=1S/C27H33N5O4/c1-27(2,3)36-26(35)32-15-13-31(14-16-32)18-19-9-11-20(12-10-19)28-24(33)17-23-21-7-5-6-8-22(21)25(34)30(4)29-23/h5-12H,13-18H2,1-4H3,(H,28,33)
InChIKey
GSXXTLWPQMHHDJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of tert-Butyl 4-(4-(2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido)benzyl)piperazine-1-carboxylate
CAS: 1311174-68-1
CID: 71451956
Formula: C27H33N5O4
MW: 491.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight491.6
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass491.25325455
Monoisotopic Mass491.25325455
Topological Polar Surface Area94.6 Ų
Heavy Atom Count36
Formal Charge0
Complexity838
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T9901A-1558-01IN-002
T39190-01ATX-002
T26503-01AB-002
T85542-01ABX-002
T9901A-1582-01RTX-002
TP2918-01CZEN-002
T9901A-1653-01VRDN-002
T9901A-1651-01IDB-002
T9901A-1053-01YH-002
T211133-01I3IN-002

Alternative Products

CatalogName
MBS5755369PH-002
A19297-5PH-002 5mg
A19297-1PH-002 1mg
A19297-100PH-002 100mg
A19297-25PH-002 25mg
A19297-10PH-002 10mg
A19297-50PH-002 50mg
A19297-10mM-DPH-002 10mM * 1mL in DMSO
HY-P991494IN-002
BA2955-1IST5-002

Popular Products