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EHop-016

CAT: 1410-M11575-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M11575-03Size:10 mg
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Description
EHop-016 is a specific Rac GTPase inhibitor with IC50 of 1.1 μM for Rac1 in MDA-MB-435 and MDA-MB-231 cells, equally potent inhibition for Rac3.
CAS Number
1380432-32-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
430.55
Molecular Formula
C25H30N6O
Notes
Research use only, not for human use.
Receptor
Rac1

Chemical Information

N4-(9-ethyl-9H-carbazol-3-yl)-N2-(3-morpholin-4-ylpropyl)-pyrimidine-2,4-diamine

EHop-016 is an organic molecular entity. It has a role as an EC 3.6.5.2 (small monomeric GTPase) inhibitor.

CAS Number1380432-32-5
PubChem CID51031035
IUPAC Name4-N-(9-ethylcarbazol-3-yl)-2-N-(3-morpholin-4-ylpropyl)pyrimidine-2,4-diamine
Molecular FormulaC25H30N6O
Molecular Weight430.5
XLogP4.1
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count32
Formal Charge0
Complexity573
SMILES
CCN1C2=C(C=C(C=C2)NC3=NC(=NC=C3)NCCCN4CCOCC4)C5=CC=CC=C51
InChI
InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29)
InChIKey
AFTZZRFCMOAFCR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N4-(9-ethyl-9H-carbazol-3-yl)-N2-(3-morpholin-4-ylpropyl)-pyrimidine-2,4-diamine
CAS: 1380432-32-5
CID: 51031035
Formula: C25H30N6O
MW: 430.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight430.5
XLogP34.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass430.24810960
Monoisotopic Mass430.24810960
Topological Polar Surface Area67.2 Ų
Heavy Atom Count32
Formal Charge0
Complexity573
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

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CatalogName
448102-01EHop-016
A12740-10EHop-016 10mg
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A12740-100EHop-016 100mg
A12740-25EHop-016 25mg

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