MedKoo Cat#: 123924 | Name: PARP1-IN-6
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

PARP1-IN-6 is a dual tubulin/PARP-1 inhibitor.

Chemical Structure

PARP1-IN-6
PARP1-IN-6
CAS#1654735-36-0

Theoretical Analysis

MedKoo Cat#: 123924

Name: PARP1-IN-6

CAS#: 1654735-36-0

Chemical Formula: C16H11FN2O

Exact Mass: 266.0855

Molecular Weight: 266.28

Elemental Analysis: C, 72.17; H, 4.16; F, 7.13; N, 10.52; O, 6.01

Price and Availability

Size Price Availability Quantity
100mg USD 950.00 2 Weeks
200mg USD 1,450.00 2 Weeks
500mg USD 2,850.00 2 Weeks
1g USD 3,850.00 2 Weeks
2g USD 6,250.00 2 Weeks
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Related CAS #
No Data
Synonym
PARP1-IN-6; PARP1-IN 6; PARP1 IN-6; PARP1 IN 6
IUPAC/Chemical Name
(E)-2-(3-fluorostyryl)quinazolin-4(3H)-one
InChi Key
ZFGIVIZXCYOWBK-CMDGGOBGSA-N
InChi Code
InChI=1S/C16H11FN2O/c17-12-5-3-4-11(10-12)8-9-15-18-14-7-2-1-6-13(14)16(20)19-15/h1-10H,(H,18,19,20)/b9-8+
SMILES Code
O=C1C2=CC=CC=C2N=C(/C=C/C3=CC(F)=CC=C3)N1
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 266.28 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Zheng L, Ren R, Sun X, Zou Y, Shi Y, Di B, Niu MM. Discovery of a Dual Tubulin and Poly(ADP-Ribose) Polymerase-1 Inhibitor by Structure-Based Pharmacophore Modeling, Virtual Screening, Molecular Docking, and Biological Evaluation. J Med Chem. 2021 Nov 11;64(21):15702-15715. doi: 10.1021/acs.jmedchem.1c00932. Epub 2021 Oct 21. PMID: 34670362.