C999-1281 Screening compound: 3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

C999-1281 Screening compound: 3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
C999-1281 Screening compound: 3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C999-1281
3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

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

C999-1281

Molecular Formula

C25H31N5O3 (C25 H31 N5 O3)

Compound Name

3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

IUPAC name

3-[3-(2-methoxyphenyl)-46-dimethyl-1H-pyrazolo[34-b]pyridin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

SMILES

Cc1c(c(-c(cccc2)c2OC)nn2CCC(NCCCN(CCC3)C3=O)=O)c2nc(C)c1

InChI

InChI=1S/C25H31N5O3/c1-17-16-18(2)27-25-23(17)24(19-8-4-5-9-20(19)33-3)28-30(25)15-11-21(31)26-12-7-14-29-13-6-10-22(29)32/h4-5,8-9,16H,6-7,10-15H2,1-3H3,(H,26,31)

InChI Key

RPJHRCPJYJPKLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14810167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.379

Distribution Coefficient, logD

1.379

Water Solubility, LogSw

-2.23

Polar Surface Area

72.660

Acid Dissociation Constant (pKa)

15.31

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

C999-1281 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C999-1281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C999-1281?
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What is the minimum amount of C999-1281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C999-1281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C999-1281
  • 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 C999-1281 available by request