F340-2112 Screening compound: 2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide

F340-2112 Screening compound: 2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide
F340-2112 Screening compound: 2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F340-2112
2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide

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

F340-2112

Molecular Formula

C23H26BrN5O (C23 H26 BrN5 O)

Compound Name

2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide

IUPAC name

2-bromo-N-[(E)-N'-(2-ethylphenyl)-N-[(135-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]benzamide

SMILES

CCc(cccc1)c1/N=C(\NCc1c(C)n(C)nc1C)/NC(c(cccc1)c1Br)=O

InChI

InChI=1S/C23H26BrN5O/c1-5-17-10-6-9-13-21(17)26-23(25-14-19-15(2)28-29(4)16(19)3)27-22(30)18-11-7-8-12-20(18)24/h6-13H,5,14H2,1-4H3,(H2,25,26,27,30)

InChI Key

HIIQYSIPUYTOLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14949595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.718

Distribution Coefficient, logD

3.380

Water Solubility, LogSw

-4.15

Polar Surface Area

55.993

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with F340-2112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F340-2112?
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What is the minimum amount of F340-2112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F340-2112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F340-2112
  • 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 F340-2112 available by request