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SRI-31040

CAT: 0804-HY-112580Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-112580Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SRI-31040 is an active compound.
CAS Number
1928715-72-3
UNSPSC
12352005
Target
Drug Derivative
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/sri-31040.html
Smiles
CC1=CC2=NC=CN2C=C1C3=NC4=C(C(NCC(C5=CC=CN5)C6=CC=CC=C6)=N3)C=CC=C4
Molecular Formula
C28H24N6
Molecular Weight
444.53
References & Citations
[1]Studies of the biogenic amine transporters 15. Identification of novel allosteric dopamine transporter ligands with nanomolar potency
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Pyrrol-2-yl)ethyl)quinazolin-4-amine
CAS Number1928715-72-3
PubChem CID121377380
IUPAC Name2-(7-methylimidazo[1,2-a]pyridin-6-yl)-N-[2-phenyl-2-(1H-pyrrol-2-yl)ethyl]quinazolin-4-amine
Molecular FormulaC28H24N6
Molecular Weight444.5
XLogP6
Topological Polar Surface Area70.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count34
Formal Charge0
Complexity653
SMILES
CC1=CC2=NC=CN2C=C1C3=NC4=CC=CC=C4C(=N3)NCC(C5=CC=CC=C5)C6=CC=CN6
InChI
InChI=1S/C28H24N6/c1-19-16-26-30-14-15-34(26)18-23(19)28-32-25-11-6-5-10-21(25)27(33-28)31-17-22(24-12-7-13-29-24)20-8-3-2-4-9-20/h2-16,18,22,29H,17H2,1H3,(H,31,32,33)
InChIKey
CAOMNZSXVHTTQZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrrol-2-yl)ethyl)quinazolin-4-amine
CAS: 1928715-72-3
CID: 121377380
Formula: C28H24N6
MW: 444.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.5
XLogP36
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass444.20624479
Monoisotopic Mass444.20624479
Topological Polar Surface Area70.9 Ų
Heavy Atom Count34
Formal Charge0
Complexity653
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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