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UCPH-101

CAT: 0931-T4138-05Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T4138-05Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1118460-77-7
Target
Transporter
Related Pathways
Metabolism
Purity
0.9858
Bioactivity
UCPH-101 is an inhibitor of excitatory amino acid transporter subtype 1 (EAAT1) with an IC50 of 0.66 μM.
Smiles
COc1ccc(cc1)C1C(C#N)=C(N)OC2=C1C(=O)CC(C2)c1cccc2ccccc12
Molecular Formula
C27H22N2O3
Molecular Weight
422.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ucph-101
CAS Number1118460-77-7
PubChem CID25223366
IUPAC Name2-amino-4-(4-methoxyphenyl)-7-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile
Molecular FormulaC27H22N2O3
Molecular Weight422.5
XLogP4.6
Topological Polar Surface Area85.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count32
Formal Charge0
Complexity857
SMILES
COC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)C4=CC=CC5=CC=CC=C54)N)C#N
InChI
InChI=1S/C27H22N2O3/c1-31-19-11-9-17(10-12-19)25-22(15-28)27(29)32-24-14-18(13-23(30)26(24)25)21-8-4-6-16-5-2-3-7-20(16)21/h2-12,18,25H,13-14,29H2,1H3
InChIKey
YBMGNDPBARCLFT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ucph-101
CAS: 1118460-77-7
CID: 25223366
Formula: C27H22N2O3
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP34.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass422.16304257
Monoisotopic Mass422.16304257
Topological Polar Surface Area85.3 Ų
Heavy Atom Count32
Formal Charge0
Complexity857
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
MBS3607140-01UCPH-101
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A13099-50UCPH 101 50mg
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A13099-5UCPH 101 5mg

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