P244-0849 Screening compound: 6-(4-chlorophenyl)-7-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one

P244-0849 Screening compound: 6-(4-chlorophenyl)-7-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one
P244-0849 Screening compound: 6-(4-chlorophenyl)-7-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P244-0849
6-(4-chlorophenyl)-7-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-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

P244-0849

Molecular Formula

C22H22ClN3O4 (C22 H22 ClN3 O4)

Compound Name

6-(4-chlorophenyl)-7-(2-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one

IUPAC name

6-(4-chlorophenyl)-7-(2-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-2-oxoethyl)-5H6H7H-pyrrolo[34-b]pyridin-5-one

SMILES

O=C(CC(c(nccc1)c1C1=O)N1c(cc1)ccc1Cl)N(CC1)CCC11OCCO1

InChI

InChI=1S/C22H22ClN3O4/c23-15-3-5-16(6-4-15)26-18(20-17(21(26)28)2-1-9-24-20)14-19(27)25-10-7-22(8-11-25)29-12-13-30-22/h1-6,9,18H,7-8,10-14H2/t18-/m0/s1

InChI Key

YAANLBCGBGKZHW-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27570274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.89

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.053

Distribution Coefficient, logD

2.053

Water Solubility, LogSw

-3.03

Polar Surface Area

56.096

Acid Dissociation Constant (pKa)

20.78

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

P244-0849 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P244-0849 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P244-0849?
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What is the minimum amount of P244-0849 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P244-0849
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P244-0849
  • 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 P244-0849 available by request