1124-0169 Screening compound: 2-{2-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-4-one

1124-0169 Screening compound: 2-{2-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-4-one
1124-0169 Screening compound: 2-{2-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1124-0169
2-{2-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-4-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

1124-0169

Molecular Formula

C19H14BrN5O2 (C19 H14 BrN5 O2)

Compound Name

2-{2-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-{2-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}-3-(prop-2-en-1-yl)-34-dihydroquinazolin-4-one

SMILES

C=CCN1C(N/N=C(\c(cc(cc2)Br)c2N2)/C2=O)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C19H14BrN5O2/c1-2-9-25-18(27)12-5-3-4-6-14(12)22-19(25)24-23-16-13-10-11(20)7-8-15(13)21-17(16)26/h2-8,10H,1,9H2,(H,22,24)(H,21,23,26)

InChI Key

YTTZFPIEPAMBFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00614734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.479

Distribution Coefficient, logD

3.213

Water Solubility, LogSw

-3.88

Polar Surface Area

70.556

Acid Dissociation Constant (pKa)

7.47

Base Dissociation Constant (pKb)

2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

1124-0169 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1124-0169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1124-0169?
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What is the minimum amount of 1124-0169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1124-0169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1124-0169
  • 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 1124-0169 available by request