P201-0029 Screening compound: 1-methyl-6-({3-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one

P201-0029 Screening compound: 1-methyl-6-({3-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one
P201-0029 Screening compound: 1-methyl-6-({3-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P201-0029
1-methyl-6-({3-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-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

P201-0029

Molecular Formula

C19H18N4O2 (C19 H18 N4 O2)

Compound Name

1-methyl-6-({3-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one

IUPAC name

1-methyl-6-({3-[(4-methylphenyl)methyl]-124-oxadiazol-5-yl}methyl)-1H6H7H-pyrrolo[23-c]pyridin-7-one

SMILES

Cc1ccc(Cc2noc(CN(C=Cc3c4n(C)cc3)C4=O)n2)cc1

InChI

InChI=1S/C19H18N4O2/c1-13-3-5-14(6-4-13)11-16-20-17(25-21-16)12-23-10-8-15-7-9-22(2)18(15)19(23)24/h3-10H,11-12H2,1-2H3

InChI Key

JJKBNRCKBWCJFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.322

Distribution Coefficient, logD

2.322

Water Solubility, LogSw

-2.69

Polar Surface Area

50.819

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

P201-0029 in Drug Discovery

Included in Screening Libraries

Bromodomain Modulators Library (5801 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P201-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of P201-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P201-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P201-0029
  • 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 P201-0029 available by request