G531-0256 Screening compound: 3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(2-methoxyphenyl)-3-methylurea

G531-0256 Screening compound: 3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(2-methoxyphenyl)-3-methylurea
G531-0256 Screening compound: 3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(2-methoxyphenyl)-3-methylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound G531-0256
3-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(2-methoxyphenyl)-3-methylurea

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

G531-0256

Molecular Formula

C18H26N4O2 (C18 H26 N4 O2)

Compound Name

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

IUPAC name

3-[2-(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)ethyl]-1-(2-methoxyphenyl)-3-methylurea

SMILES

CCn1nc(C)c(CCN(C)C(Nc(cccc2)c2OC)=O)c1C

InChI

InChI=1S/C18H26N4O2/c1-6-22-14(3)15(13(2)20-22)11-12-21(4)18(23)19-16-9-7-8-10-17(16)24-5/h7-10H,6,11-12H2,1-5H3,(H,19,23)

InChI Key

HVAXBOBSMSJGGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27142694

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.591

Distribution Coefficient, logD

2.590

Water Solubility, LogSw

-2.97

Polar Surface Area

46.399

Acid Dissociation Constant (pKa)

11.67

Base Dissociation Constant (pKb)

4.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

G531-0256 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G531-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G531-0256?
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What is the minimum amount of G531-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G531-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G531-0256
  • 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 G531-0256 available by request