3279-5175 Screening compound: 2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)-3,4-dihydroquinazolin-3-yl]benzamide

3279-5175 Screening compound: 2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)-3,4-dihydroquinazolin-3-yl]benzamide
3279-5175 Screening compound: 2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)-3,4-dihydroquinazolin-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3279-5175
2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)-3,4-dihydroquinazolin-3-yl]benzamide

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

3279-5175

Molecular Formula

C19H10ClN5O6S (C19 H10 ClN5 O6 S)

Compound Name

2-chloro-3,5-dinitro-N-[4-oxo-2-(thiophen-2-yl)-3,4-dihydroquinazolin-3-yl]benzamide

IUPAC name

2-chloro-35-dinitro-N-[4-oxo-2-(thiophen-2-yl)-34-dihydroquinazolin-3-yl]benzamide

SMILES

[O-][N+](c(cc1C(NN(C(c2cccs2)=Nc2c3cccc2)C3=O)=O)cc([N+]([O-])=O)c1Cl)=O

InChI

InChI=1S/C19H10ClN5O6S/c20-16-12(8-10(24(28)29)9-14(16)25(30)31)18(26)22-23-17(15-6-3-7-32-15)21-13-5-2-1-4-11(13)19(23)27/h1-9H,(H,22,26)

InChI Key

QUKFVAHYZROZHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02087109

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.84

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.539

Distribution Coefficient, logD

2.189

Water Solubility, LogSw

-3.98

Polar Surface Area

119.232

Acid Dissociation Constant (pKa)

7.31

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 3279-5175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3279-5175?
Check Price and Availability of 3279-5175, 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 3279-5175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3279-5175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3279-5175
  • 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 3279-5175 available by request