1697-1519 Screening compound: (4E)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one

1697-1519 Screening compound: (4E)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one
1697-1519 Screening compound: (4E)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1697-1519
(4E)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one

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

1697-1519

Molecular Formula

C20H16N6O4S (C20 H16 N6 O4 S)

Compound Name

(4E)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one

IUPAC name

(4E)-1-[4-(4-methoxyphenyl)-13-thiazol-2-yl]-3-methyl-4-[2-(2-nitrophenyl)hydrazin-1-ylidene]-45-dihydro-1H-pyrazol-5-one

SMILES

CC(/C(/C1=O)=N\Nc(cccc2)c2[N+]([O-])=O)=NN1c1nc(-c(cc2)ccc2OC)cs1

InChI

InChI=1S/C20H16N6O4S/c1-12-18(23-22-15-5-3-4-6-17(15)26(28)29)19(27)25(24-12)20-21-16(11-31-20)13-7-9-14(30-2)10-8-13/h3-11,22H,1-2H3

InChI Key

MSTTYPGZSIBVFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01246814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.422

Distribution Coefficient, logD

5.413

Water Solubility, LogSw

-5.46

Polar Surface Area

95.037

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

1697-1519 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1697-1519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1697-1519?
Check Price and Availability of 1697-1519, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 1697-1519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1697-1519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1697-1519
  • 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 1697-1519 available by request