3091-4655 Screening compound: N-[2-(3,5-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide

3091-4655 Screening compound: N-[2-(3,5-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide
3091-4655 Screening compound: N-[2-(3,5-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3091-4655
N-[2-(3,5-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide

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

3091-4655

Molecular Formula

C24H20N4O6 (C24 H20 N4 O6)

Compound Name

N-[2-(3,5-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide

IUPAC name

N-[2-(35-dimethoxyphenyl)-4-oxo-34-dihydroquinazolin-3-yl]-2-(4-nitrophenyl)acetamide

SMILES

COc1cc(C(N2NC(Cc(cc3)ccc3[N+]([O-])=O)=O)=Nc(cccc3)c3C2=O)cc(OC)c1

InChI

InChI=1S/C24H20N4O6/c1-33-18-12-16(13-19(14-18)34-2)23-25-21-6-4-3-5-20(21)24(30)27(23)26-22(29)11-15-7-9-17(10-8-15)28(31)32/h3-10,12-14H,11H2,1-2H3,(H,26,29)

InChI Key

XSWYCKWISNSYPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02086020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.45

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.665

Distribution Coefficient, logD

2.665

Water Solubility, LogSw

-3.42

Polar Surface Area

100.007

Acid Dissociation Constant (pKa)

10.93

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 3091-4655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3091-4655?
Check Price and Availability of 3091-4655, 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 3091-4655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3091-4655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3091-4655
  • 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 3091-4655 available by request