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Antiproliferative agent-15

CAT: 0804-HY-W278944-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W278944-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Antiproliferative agent-15 is an thienopyrimidine derivated anticancer agent. Antiproliferative agent-15 shows antiproliferative activity against human colon (HCT116 and HCT15) and brain (LN-229 and GBM-10) cancer cell lines[1].
CAS Number
19819-18-2
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Drug Derivative
Type
Reference compound
Related Pathways
Others
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/antiproliferative-agent-15.html
Purity
99.18
Solubility
DMSO : 1.67 mg/mL (ultrasonic)
Smiles
O=C1C(C(CCCC2)=C2S3)=C3N=C(C4=CC=CC=C4)N1
Molecular Formula
C16H14N2OS
Molecular Weight
282.37
Precautions
H302, H315, H319, H335
References & Citations
[1]Haneen Amawi, et al. Thienopyrimidine derivatives exert their anticancer efficacy via apoptosis induction, oxidative stress and mitotic catastrophe. Eur J Med Chem. 2017 Sep 29;138:1053-1065.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

5,6,7,8-Tetrahydro-2-phenyl(1)benzothieno(2,3-d)pyrimidin-4(1H)-one
CAS Number19819-18-2
PubChem CID209396
IUPAC Name2-phenyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Molecular FormulaC16H14N2OS
Molecular Weight282.4
XLogP3.6
Topological Polar Surface Area69.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity430
SMILES
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4=CC=CC=C4
InChI
InChI=1S/C16H14N2OS/c19-15-13-11-8-4-5-9-12(11)20-16(13)18-14(17-15)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,17,18,19)
InChIKey
CDFWRIZOSNAGCV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,6,7,8-Tetrahydro-2-phenyl(1)benzothieno(2,3-d)pyrimidin-4(1H)-one
CAS: 19819-18-2
CID: 209396
Formula: C16H14N2OS
MW: 282.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight282.4
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass282.08268425
Monoisotopic Mass282.08268425
Topological Polar Surface Area69.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity430
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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