Y020-8944 Screening compound: 1-[9-(2,4-dimethoxyphenyl)-1,7-dioxo-1H,2H,7H,8H,9H,10H-pyrimido[4,5-c]isoquinolin-3-yl]piperidine-4-carboxamide

Y020-8944 Screening compound: 1-[9-(2,4-dimethoxyphenyl)-1,7-dioxo-1H,2H,7H,8H,9H,10H-pyrimido[4,5-c]isoquinolin-3-yl]piperidine-4-carboxamide
Y020-8944 Screening compound: 1-[9-(2,4-dimethoxyphenyl)-1,7-dioxo-1H,2H,7H,8H,9H,10H-pyrimido[4,5-c]isoquinolin-3-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8944
1-[9-(2,4-dimethoxyphenyl)-1,7-dioxo-1H,2H,7H,8H,9H,10H-pyrimido[4,5-c]isoquinolin-3-yl]piperidine-4-carboxamide

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

Y020-8944

Molecular Formula

C25H27N5O5 (C25 H27 N5 O5)

Compound Name

1-[9-(2,4-dimethoxyphenyl)-1,7-dioxo-1H,2H,7H,8H,9H,10H-pyrimido[4,5-c]isoquinolin-3-yl]piperidine-4-carboxamide

IUPAC name

1-[9-(24-dimethoxyphenyl)-17-dioxo-1H2H7H8H9H10H-pyrimido[45-c]isoquinolin-3-yl]piperidine-4-carboxamide

SMILES

COc1cc(OC)c(C(Cc2c3cnc(N=C(N4)N(CC5)CCC5C(N)=O)c2C4=O)CC3=O)cc1

InChI

InChI=1S/C25H27N5O5/c1-34-15-3-4-16(20(11-15)35-2)14-9-17-18(19(31)10-14)12-27-23-21(17)24(33)29-25(28-23)30-7-5-13(6-8-30)22(26)32/h3-4,11-14H,5-10H2,1-2H3,(H2,26,32)(H,27,28,29,33)/t14-/m1/s1

InChI Key

WPBMHKFBAAXQHT-CQSZACIVSA-N

MDL Number (MFCD)

MFCD12211163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.211

Distribution Coefficient, logD

2.182

Water Solubility, LogSw

-3.06

Polar Surface Area

109.800

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with Y020-8944 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8944?
Check Price and Availability of Y020-8944, 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 Y020-8944 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8944
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8944
  • 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 Y020-8944 available by request