8018-8280 Screening compound: 2-(3,4-dimethoxyphenyl)pyrimido[1,2-a][1,3]benzimidazol-4(1H)-one

8018-8280 Screening compound: 2-(3,4-dimethoxyphenyl)pyrimido[1,2-a][1,3]benzimidazol-4(1H)-one
8018-8280 Screening compound: 2-(3,4-dimethoxyphenyl)pyrimido[1,2-a][1,3]benzimidazol-4(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8280
2-(3,4-dimethoxyphenyl)pyrimido[1,2-a][1,3]benzimidazol-4(1H)-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8018-8280

Molecular Formula

C18H15N3O3 (C18 H15 N3 O3)

Compound Name

2-(3,4-dimethoxyphenyl)pyrimido[1,2-a][1,3]benzimidazol-4(1H)-one

IUPAC name

11-(34-dimethoxyphenyl)-1810-triazatricyclo[7.4.0.0^{27}]trideca-2(7)35811-pentaen-13-one

SMILES

COc(ccc(C(Nc1nc(cccc2)c2n11)=CC1=O)c1)c1OC

InChI

InChI=1S/C18H15N3O3/c1-23-15-8-7-11(9-16(15)24-2)13-10-17(22)21-14-6-4-3-5-12(14)19-18(21)20-13/h3-10H,1-2H3,(H,19,20)

InChI Key

MLIPCSKLNQGSJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08132701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.549

Distribution Coefficient, logD

2.497

Water Solubility, LogSw

-3.13

Polar Surface Area

53.481

Acid Dissociation Constant (pKa)

8.30

Base Dissociation Constant (pKb)

-0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8018-8280 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8018-8280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8280?
Check Price and Availability of 8018-8280, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8018-8280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8280
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8018-8280 available by request