G531-0152 Screening compound: 1-(2,4-difluorophenyl)-3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea

G531-0152 Screening compound: 1-(2,4-difluorophenyl)-3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea
G531-0152 Screening compound: 1-(2,4-difluorophenyl)-3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G531-0152
1-(2,4-difluorophenyl)-3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]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

G531-0152

Molecular Formula

C16H20F2N4O (C16 H20 F2 N4 O)

Compound Name

1-(2,4-difluorophenyl)-3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea

IUPAC name

1-(24-difluorophenyl)-3-[2-(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)ethyl]urea

SMILES

CCn1nc(C)c(CCNC(Nc(ccc(F)c2)c2F)=O)c1C

InChI

InChI=1S/C16H20F2N4O/c1-4-22-11(3)13(10(2)21-22)7-8-19-16(23)20-15-6-5-12(17)9-14(15)18/h5-6,9H,4,7-8H2,1-3H3,(H2,19,20,23)

InChI Key

WAGKEWYDCNEDNT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15016398

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.152

Distribution Coefficient, logD

2.149

Water Solubility, LogSw

-2.87

Polar Surface Area

47.285

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

G531-0152 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G531-0152 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G531-0152?
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What is the minimum amount of G531-0152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G531-0152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G531-0152
  • 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 G531-0152 available by request