D155-0050 Screening compound: (2Z)-1-(2,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one

D155-0050 Screening compound: (2Z)-1-(2,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one
D155-0050 Screening compound: (2Z)-1-(2,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D155-0050
(2Z)-1-(2,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-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

D155-0050

Molecular Formula

C19H15Cl2N3O3 (C19 H15 Cl2 N3 O3)

Compound Name

(2Z)-1-(2,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)prop-2-en-1-one

IUPAC name

(2Z)-1-(24-dichlorophenyl)-3-(34-dimethoxyphenyl)-2-(1H-124-triazol-1-yl)prop-2-en-1-one

SMILES

COc(ccc(/C=C(/C(c(ccc(Cl)c1)c1Cl)=O)\n1ncnc1)c1)c1OC

InChI

InChI=1S/C19H15Cl2N3O3/c1-26-17-6-3-12(8-18(17)27-2)7-16(24-11-22-10-23-24)19(25)14-5-4-13(20)9-15(14)21/h3-11H,1-2H3

InChI Key

WHDYPCAWESWZJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.927

Distribution Coefficient, logD

3.927

Water Solubility, LogSw

-4.49

Polar Surface Area

52.672

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

D155-0050 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antibacterial Compounds Library (13827 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D155-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D155-0050?
Check Price and Availability of D155-0050, 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 D155-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D155-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D155-0050
  • 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 D155-0050 available by request