8561-07733 Screening compound: 4-(5,6-dihydro[1,3]benzimidazo[1,2-c]quinazolin-6-yl)-2-ethoxyphenol

8561-07733 Screening compound: 4-(5,6-dihydro[1,3]benzimidazo[1,2-c]quinazolin-6-yl)-2-ethoxyphenol
8561-07733 Screening compound: 4-(5,6-dihydro[1,3]benzimidazo[1,2-c]quinazolin-6-yl)-2-ethoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8561-07733
4-(5,6-dihydro[1,3]benzimidazo[1,2-c]quinazolin-6-yl)-2-ethoxyphenol

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

8561-07733

Molecular Formula

C22H19N3O2 (C22 H19 N3 O2)

Compound Name

4-(5,6-dihydro[1,3]benzimidazo[1,2-c]quinazolin-6-yl)-2-ethoxyphenol

IUPAC name

2-ethoxy-4-{81017-triazatetracyclo[8.7.0.0^{27}.0^{1116}]heptadeca-1(17)2(7)35111315-heptaen-9-yl}phenol

SMILES

CCOc(cc(C(Nc1c-2cccc1)n1c2nc2c1cccc2)cc1)c1O

InChI

InChI=1S/C22H19N3O2/c1-2-27-20-13-14(11-12-19(20)26)21-23-16-8-4-3-7-15(16)22-24-17-9-5-6-10-18(17)25(21)22/h3-13,21,23,26H,2H2,1H3/t21-/m0/s1

InChI Key

BODDTJGWFOKIOQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02713103

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.466

Distribution Coefficient, logD

4.447

Water Solubility, LogSw

-3.97

Polar Surface Area

46.186

Acid Dissociation Constant (pKa)

9.17

Base Dissociation Constant (pKb)

5.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

8561-07733 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8561-07733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8561-07733?
Check Price and Availability of 8561-07733, 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 8561-07733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8561-07733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8561-07733
  • 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 8561-07733 available by request