8006-6699 Screening compound: 1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-1,4-dihydroquinoline-3-carboxylic acid

8006-6699 Screening compound: 1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-1,4-dihydroquinoline-3-carboxylic acid
8006-6699 Screening compound: 1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-1,4-dihydroquinoline-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-6699
1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-1,4-dihydroquinoline-3-carboxylic acid

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

8006-6699

Molecular Formula

C19H16FN3O3 (C19 H16 FN3 O3)

Compound Name

1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-1,4-dihydroquinoline-3-carboxylic acid

IUPAC name

1-ethyl-6-fluoro-4-oxo-7-[(2E)-2-(phenylmethylidene)hydrazin-1-yl]-14-dihydroquinoline-3-carboxylic acid

SMILES

CCN(C=C(C(O)=O)C(c1c2)=O)c1cc(N/N=C/c1ccccc1)c2F

InChI

InChI=1S/C19H16FN3O3/c1-2-23-11-14(19(25)26)18(24)13-8-15(20)16(9-17(13)23)22-21-10-12-6-4-3-5-7-12/h3-11,22H,2H2,1H3,(H,25,26)

InChI Key

QKQWGPDOUYDQFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00761935

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.331

Distribution Coefficient, logD

0.145

Water Solubility, LogSw

-3.00

Polar Surface Area

64.406

Acid Dissociation Constant (pKa)

5.22

Base Dissociation Constant (pKb)

2.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

8006-6699 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8006-6699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-6699?
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What is the minimum amount of 8006-6699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-6699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-6699
  • 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 8006-6699 available by request