3807-1820 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one

3807-1820 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one
3807-1820 Screening compound: 2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-1820
2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-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

3807-1820

Molecular Formula

C25H18N4O3 (C25 H18 N4 O3)

Compound Name

2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-nitrophenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-[(1E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-nitrophenyl)-34-dihydroquinazolin-4-one

SMILES

Cc1c(/C=C/C(N2c(cccc3)c3[N+]([O-])=O)=Nc(cccc3)c3C2=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C25H18N4O3/c1-16-17(18-8-2-4-10-20(18)26-16)14-15-24-27-21-11-5-3-9-19(21)25(30)28(24)22-12-6-7-13-23(22)29(31)32/h2-15,26H,1H3

InChI Key

HKIWMYACLMTZAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01897728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.252

Distribution Coefficient, logD

4.252

Water Solubility, LogSw

-4.47

Polar Surface Area

67.300

Acid Dissociation Constant (pKa)

18.23

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

References: we are preparing a list of scientific research reports with 3807-1820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-1820?
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What is the minimum amount of 3807-1820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-1820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-1820
  • 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 3807-1820 available by request