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UP158

CAT: 0931-T203467-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T203467-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
489402-33-7
Target
P97
Related Pathways
Ubiquitination
Bioactivity
UP158 enhances ATPase activity and stimulates valosin-containing protein (VCP), with an EC50 of 2.57 μM.
Smiles
ClC=1C=CC=2NC=3C(=NC=NC3N4CCC5(OCCO5)CC4)C2C1
Molecular Formula
C17H17ClN4O2
Molecular Weight
344.8
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

8-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane

8-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane is a pyrimido-indole and an azaspiro compound.

CAS Number489402-33-7
PubChem CID3601679
IUPAC Name8-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane
Molecular FormulaC17H17ClN4O2
Molecular Weight344.8
XLogP2.8
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity466
SMILES
C1CN(CCC12OCCO2)C3=NC=NC4=C3NC5=C4C=C(C=C5)Cl
InChI
InChI=1S/C17H17ClN4O2/c18-11-1-2-13-12(9-11)14-15(21-13)16(20-10-19-14)22-5-3-17(4-6-22)23-7-8-24-17/h1-2,9-10,21H,3-8H2
InChIKey
UEXINIASTXLPIV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-(8-chloro-5H-pyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane
CAS: 489402-33-7
CID: 3601679
Formula: C17H17ClN4O2
MW: 344.8
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.8
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass344.1040035
Monoisotopic Mass344.1040035
Topological Polar Surface Area63.3 Ų
Heavy Atom Count24
Formal Charge0
Complexity466
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

Alternative Products

CatalogName
GTR19241177-01UP158

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