F430-1152 Screening compound: N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide

F430-1152 Screening compound: N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide
F430-1152 Screening compound: N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F430-1152
N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide

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

F430-1152

Molecular Formula

C21H18BrFN4O (C21 H18 BrFN4 O)

Compound Name

N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide

IUPAC name

N-[(E)-N'-(4-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]-3-fluoro-4-methylbenzamide

SMILES

Cc(ccc(C(N/C(/NCc1ccncc1)=N/c(cc1)ccc1Br)=O)c1)c1F

InChI

InChI=1S/C21H18BrFN4O/c1-14-2-3-16(12-19(14)23)20(28)27-21(25-13-15-8-10-24-11-9-15)26-18-6-4-17(22)5-7-18/h2-12H,13H2,1H3,(H2,25,26,27,28)

InChI Key

KZJQHQHPQKAKFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27127887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.989

Distribution Coefficient, logD

3.892

Water Solubility, LogSw

-4.05

Polar Surface Area

51.280

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

6.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with F430-1152 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F430-1152?
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What is the minimum amount of F430-1152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F430-1152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F430-1152
  • 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 F430-1152 available by request