1319-0046 Screening compound: (2Z)-N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide

1319-0046 Screening compound: (2Z)-N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide
1319-0046 Screening compound: (2Z)-N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1319-0046
(2Z)-N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide

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

1319-0046

Molecular Formula

C18H11Cl2FN2O3 (C18 H11 Cl2 FN2 O3)

Compound Name

(2Z)-N-acetyl-6,8-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide

IUPAC name

(2Z)-N-acetyl-68-dichloro-2-[(3-fluorophenyl)imino]-2H-chromene-3-carboxamide

SMILES

CC(NC(C1=Cc2cc(Cl)cc(Cl)c2O/C1=N\c1cc(F)ccc1)=O)=O

InChI

InChI=1S/C18H11Cl2FN2O3/c1-9(24)22-17(25)14-6-10-5-11(19)7-15(20)16(10)26-18(14)23-13-4-2-3-12(21)8-13/h2-8H,1H3,(H,22,24,25)

InChI Key

NTIGBFJIYNTQKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.2

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.586

Distribution Coefficient, logD

3.549

Water Solubility, LogSw

-4.13

Polar Surface Area

53.070

Acid Dissociation Constant (pKa)

8.45

Base Dissociation Constant (pKb)

-0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

References: we are preparing a list of scientific research reports with 1319-0046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1319-0046?
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What is the minimum amount of 1319-0046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1319-0046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1319-0046
  • 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 1319-0046 available by request