G756-1074 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methoxy)phenyl]urea

G756-1074 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methoxy)phenyl]urea
G756-1074 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methoxy)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G756-1074
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methoxy)phenyl]urea

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

G756-1074

Molecular Formula

C25H22N4O5 (C25 H22 N4 O5)

Compound Name

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methoxy)phenyl]urea

IUPAC name

3-(23-dihydro-14-benzodioxin-6-yl)-1-[3-({8-methyl-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methoxy)phenyl]urea

SMILES

CC(C=CN12)=CC2=NC(COc2cc(NC(Nc(cc3)cc4c3OCCO4)=O)ccc2)=CC1=O

InChI

InChI=1S/C25H22N4O5/c1-16-7-8-29-23(11-16)26-19(14-24(29)30)15-34-20-4-2-3-17(12-20)27-25(31)28-18-5-6-21-22(13-18)33-10-9-32-21/h2-8,11-14H,9-10,15H2,1H3,(H2,27,28,31)

InChI Key

HKLPSYMBDUWPEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15032768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.807

Distribution Coefficient, logD

2.807

Water Solubility, LogSw

-3.27

Polar Surface Area

81.579

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

G756-1074 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G756-1074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G756-1074?
Check Price and Availability of G756-1074, 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 G756-1074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G756-1074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G756-1074
  • 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 G756-1074 available by request