D007-0189 Screening compound: 7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one

D007-0189 Screening compound: 7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one
D007-0189 Screening compound: 7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D007-0189
7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-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

D007-0189

Molecular Formula

C20H26N4O2 (C20 H26 N4 O2)

Compound Name

7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one

IUPAC name

7-methoxy-3-[3-(2-methylpiperidin-1-yl)propyl]-3H4H5H-pyrimido[54-b]indol-4-one

SMILES

CC1N(CCCN(C=Nc2c3[nH]c4c2ccc(OC)c4)C3=O)CCCC1

InChI

InChI=1S/C20H26N4O2/c1-14-6-3-4-9-23(14)10-5-11-24-13-21-18-16-8-7-15(26-2)12-17(16)22-19(18)20(24)25/h7-8,12-14,22H,3-6,9-11H2,1-2H3/t14-/m0/s1

InChI Key

DRIKJEYJUUURRE-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14810352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.266

Distribution Coefficient, logD

-0.082

Water Solubility, LogSw

-2.85

Polar Surface Area

45.252

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

9.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

D007-0189 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D007-0189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D007-0189?
Check Price and Availability of D007-0189, 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 D007-0189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D007-0189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D007-0189
  • 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 D007-0189 available by request