C561-1133 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

C561-1133 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
C561-1133 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-1133
3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-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

C561-1133

Molecular Formula

C25H31N5O3 (C25 H31 N5 O3)

Compound Name

3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

IUPAC name

3-[2-(2-methoxyphenyl)-57-dimethylpyrazolo[15-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide

SMILES

Cc1c(CCC(NCCCN(CCC2)C2=O)=O)c(C)nc2cc(-c(cccc3)c3OC)nn12

InChI

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

InChI Key

CHMPIPSUBCSYLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14770677

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

1.309

Distribution Coefficient, logD

1.300

Water Solubility, LogSw

-2.16

Polar Surface Area

68.905

Acid Dissociation Constant (pKa)

15.38

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

C561-1133 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 C561-1133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-1133?
Check Price and Availability of C561-1133, 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 C561-1133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-1133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-1133
  • 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 C561-1133 available by request