G532-0153 Screening compound: 1-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1-ETHYL-3,5-DIMETHYL-1H-PYRAZOL-4-YL)METHYL]UREA

G532-0153 Screening compound: 1-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1-ETHYL-3,5-DIMETHYL-1H-PYRAZOL-4-YL)METHYL]UREA
G532-0153 Screening compound: 1-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1-ETHYL-3,5-DIMETHYL-1H-PYRAZOL-4-YL)METHYL]UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound G532-0153
1-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1-ETHYL-3,5-DIMETHYL-1H-PYRAZOL-4-YL)METHYL]UREA

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

G532-0153

Molecular Formula

C16H20N4O3 (C16 H20 N4 O3)

Compound Name

1-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1-ETHYL-3,5-DIMETHYL-1H-PYRAZOL-4-YL)METHYL]UREA

IUPAC name

1-(2H-13-benzodioxol-5-yl)-3-[(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)methyl]urea

SMILES

CCn1nc(C)c(CNC(Nc(cc2)cc3c2OCO3)=O)c1C

InChI

InChI=1S/C16H20N4O3/c1-4-20-11(3)13(10(2)19-20)8-17-16(21)18-12-5-6-14-15(7-12)23-9-22-14/h5-7H,4,8-9H2,1-3H3,(H2,17,18,21)

InChI Key

JKJZGTPJMUYPEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06122725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.006

Distribution Coefficient, logD

2.006

Water Solubility, LogSw

-2.68

Polar Surface Area

65.257

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

G532-0153 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Immunological Library (6760 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with G532-0153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G532-0153?
Check Price and Availability of G532-0153, 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 G532-0153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G532-0153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G532-0153
  • 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 G532-0153 available by request