P244-0505 Screening compound: N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-7-yl]acetamide

P244-0505 Screening compound: N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-7-yl]acetamide
P244-0505 Screening compound: N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-7-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P244-0505
N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-7-yl]acetamide

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

P244-0505

Molecular Formula

C21H23N3O2 (C21 H23 N3 O2)

Compound Name

N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-7-yl]acetamide

IUPAC name

N-cyclopentyl-2-[6-(3-methylphenyl)-5-oxo-5H6H7H-pyrrolo[34-b]pyridin-7-yl]acetamide

SMILES

Cc1cccc(N(C(CC(NC2CCCC2)=O)c2c3cccn2)C3=O)c1

InChI

InChI=1S/C21H23N3O2/c1-14-6-4-9-16(12-14)24-18(13-19(25)23-15-7-2-3-8-15)20-17(21(24)26)10-5-11-22-20/h4-6,9-12,15,18H,2-3,7-8,13H2,1H3,(H,23,25)/t18-/m1/s1

InChI Key

YQVWOHAOABSYTR-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27570231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.371

Distribution Coefficient, logD

3.371

Water Solubility, LogSw

-3.73

Polar Surface Area

49.830

Acid Dissociation Constant (pKa)

15.06

Base Dissociation Constant (pKb)

0.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

P244-0505 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 P244-0505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P244-0505?
Check Price and Availability of P244-0505, 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 P244-0505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P244-0505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P244-0505
  • 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 P244-0505 available by request