3379-0310 Screening compound: 6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-3,4-dihydroquinazolin-4-one

3379-0310 Screening compound: 6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-3,4-dihydroquinazolin-4-one
3379-0310 Screening compound: 6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-0310
6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-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

3379-0310

Molecular Formula

C23H16IN3O3 (C23 H16 IN3 O3)

Compound Name

6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-3,4-dihydroquinazolin-4-one

IUPAC name

6-iodo-3-(4-methylphenyl)-2-[(1E)-2-(3-nitrophenyl)ethenyl]-34-dihydroquinazolin-4-one

SMILES

Cc(cc1)ccc1N(C(/C=C/c1cc([N+]([O-])=O)ccc1)=Nc(cc1)c2cc1I)C2=O

InChI

InChI=1S/C23H16IN3O3/c1-15-5-9-18(10-6-15)26-22(12-7-16-3-2-4-19(13-16)27(29)30)25-21-11-8-17(24)14-20(21)23(26)28/h2-14H,1H3

InChI Key

BBWSFYSENALXJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02642337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.216

Distribution Coefficient, logD

6.216

Water Solubility, LogSw

-5.57

Polar Surface Area

57.976

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 3379-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-0310?
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What is the minimum amount of 3379-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-0310
  • 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 3379-0310 available by request