F340-0081 Screening compound: N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)benzamide

F340-0081 Screening compound: N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)benzamide
F340-0081 Screening compound: N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F340-0081
N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)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

F340-0081

Molecular Formula

C24H29ClN6O (C24 H29 ClN6 O)

Compound Name

N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)benzamide

IUPAC name

N-[(E)-N'-(3-chlorophenyl)-N-[(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl]-3-(dimethylamino)benzamide

SMILES

CCn1nc(C)c(CN/C(/NC(c2cc(N(C)C)ccc2)=O)=N\c2cccc(Cl)c2)c1C

InChI

InChI=1S/C24H29ClN6O/c1-6-31-17(3)22(16(2)29-31)15-26-24(27-20-11-8-10-19(25)14-20)28-23(32)18-9-7-12-21(13-18)30(4)5/h7-14H,6,15H2,1-5H3,(H2,26,27,28,32)

InChI Key

AQZSAJAKOSSIPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14948831

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.99

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.264

Distribution Coefficient, logD

4.093

Water Solubility, LogSw

-4.53

Polar Surface Area

58.934

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

7.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with F340-0081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F340-0081?
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What is the minimum amount of F340-0081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F340-0081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F340-0081
  • 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 F340-0081 available by request