0762-0033 Screening compound: 4-[(2Z)-1-ethyl-6-methoxy-1,2-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

0762-0033 Screening compound: 4-[(2Z)-1-ethyl-6-methoxy-1,2-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
0762-0033 Screening compound: 4-[(2Z)-1-ethyl-6-methoxy-1,2-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0762-0033
4-[(2Z)-1-ethyl-6-methoxy-1,2-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-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

0762-0033

Molecular Formula

C22H21N3O2 (C22 H21 N3 O2)

Compound Name

4-[(2Z)-1-ethyl-6-methoxy-1,2-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

IUPAC name

4-[(2Z)-1-ethyl-6-methoxy-12-dihydroquinolin-2-ylidene]-3-methyl-1-phenyl-45-dihydro-1H-pyrazol-5-one

SMILES

CCN(/C(/C=C1)=C(/C(C)=NN2c3ccccc3)\C2=O)c(cc2)c1cc2OC

InChI

InChI=1S/C22H21N3O2/c1-4-24-19-13-11-18(27-3)14-16(19)10-12-20(24)21-15(2)23-25(22(21)26)17-8-6-5-7-9-17/h5-14H,4H2,1-3H3

InChI Key

CHNTZXDTYGPHBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00359120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.234

Distribution Coefficient, logD

4.234

Water Solubility, LogSw

-4.33

Polar Surface Area

36.896

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-6.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

0762-0033 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 0762-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0762-0033?
Check Price and Availability of 0762-0033, 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 0762-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0762-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0762-0033
  • 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 0762-0033 available by request