3807-1832 Screening compound: 2-{[(3E)-5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one

3807-1832 Screening compound: 2-{[(3E)-5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one
3807-1832 Screening compound: 2-{[(3E)-5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-1832
2-{[(3E)-5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-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

3807-1832

Molecular Formula

C26H19BrN4O4 (C26 H19 BrN4 O4)

Compound Name

2-{[(3E)-5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-{[(3E)-5-bromo-2-oxo-1-propyl-23-dihydro-1H-indol-3-ylidene]methyl}-3-(2-nitrophenyl)-34-dihydroquinazolin-4-one

SMILES

CCCN(c(ccc(Br)c1)c1/C1=C\C(N2c(cccc3)c3[N+]([O-])=O)=Nc(cccc3)c3C2=O)C1=O

InChI

InChI=1S/C26H19BrN4O4/c1-2-13-29-21-12-11-16(27)14-18(21)19(25(29)32)15-24-28-20-8-4-3-7-17(20)26(33)30(24)22-9-5-6-10-23(22)31(34)35/h3-12,14-15H,2,13H2,1H3

InChI Key

YNOVAMARHHXKQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14708748

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.829

Distribution Coefficient, logD

4.829

Water Solubility, LogSw

-4.63

Polar Surface Area

73.092

Acid Dissociation Constant (pKa)

26.65

Base Dissociation Constant (pKb)

2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

References: we are preparing a list of scientific research reports with 3807-1832 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-1832?
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What is the minimum amount of 3807-1832 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-1832
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-1832
  • 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 3807-1832 available by request