G663-1037 Screening compound: 2-({7-methyl-4-oxo-3H,4H,6H,7H,8H,9H-pyrimido[4,5-b]quinolin-3-yl}methyl)benzonitrile

G663-1037 Screening compound: 2-({7-methyl-4-oxo-3H,4H,6H,7H,8H,9H-pyrimido[4,5-b]quinolin-3-yl}methyl)benzonitrile
G663-1037 Screening compound: 2-({7-methyl-4-oxo-3H,4H,6H,7H,8H,9H-pyrimido[4,5-b]quinolin-3-yl}methyl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound G663-1037
2-({7-methyl-4-oxo-3H,4H,6H,7H,8H,9H-pyrimido[4,5-b]quinolin-3-yl}methyl)benzonitrile

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

G663-1037

Molecular Formula

C20H18N4O (C20 H18 N4 O)

Compound Name

2-({7-methyl-4-oxo-3H,4H,6H,7H,8H,9H-pyrimido[4,5-b]quinolin-3-yl}methyl)benzonitrile

IUPAC name

2-({7-methyl-4-oxo-3H4H6H7H8H9H-pyrimido[45-b]quinolin-3-yl}methyl)benzonitrile

SMILES

CC1Cc2cc(C(N(Cc(cccc3)c3C#N)C=N3)=O)c3nc2CC1

InChI

InChI=1S/C20H18N4O/c1-13-6-7-18-16(8-13)9-17-19(23-18)22-12-24(20(17)25)11-15-5-3-2-4-14(15)10-21/h2-5,9,12-13H,6-8,11H2,1H3/t13-/m1/s1

InChI Key

UTKOGTPWNJXHKW-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD15027131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.578

Distribution Coefficient, logD

3.577

Water Solubility, LogSw

-3.77

Polar Surface Area

54.008

Acid Dissociation Constant (pKa)

23.15

Base Dissociation Constant (pKb)

4.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

G663-1037 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

BRD4 Targeted Library (4534 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with G663-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G663-1037?
Check Price and Availability of G663-1037, 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 G663-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G663-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G663-1037
  • 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 G663-1037 available by request