G833-0176 Screening compound: 3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}propanamide

G833-0176 Screening compound: 3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}propanamide
G833-0176 Screening compound: 3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G833-0176
3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}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

G833-0176

Molecular Formula

C28H32N4O4 (C28 H32 N4 O4)

Compound Name

3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}propanamide

IUPAC name

3-[2-(2-methoxyphenyl)-45-dimethyl-7-oxo-4H7H-pyrazolo[15-a]pyrimidin-6-yl]-N-{[4-(propan-2-yloxy)phenyl]methyl}propanamide

SMILES

CC(C)Oc1ccc(CNC(CCC2=C(C)N(C)c3cc(-c(cccc4)c4OC)nn3C2=O)=O)cc1

InChI

InChI=1S/C28H32N4O4/c1-18(2)36-21-12-10-20(11-13-21)17-29-26(33)15-14-22-19(3)31(4)27-16-24(30-32(27)28(22)34)23-8-6-7-9-25(23)35-5/h6-13,16,18H,14-15,17H2,1-5H3,(H,29,33)

InChI Key

IHLXHAHXVPLBOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27164223

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.59

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

3.685

Distribution Coefficient, logD

3.685

Water Solubility, LogSw

-4.08

Polar Surface Area

65.812

Acid Dissociation Constant (pKa)

13.41

Base Dissociation Constant (pKb)

-3.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

G833-0176 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with G833-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G833-0176?
Check Price and Availability of G833-0176, 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 G833-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G833-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G833-0176
  • 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 G833-0176 available by request