E694-0156 Screening compound: 3-(benzenesulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

E694-0156 Screening compound: 3-(benzenesulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-amine
E694-0156 Screening compound: 3-(benzenesulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound E694-0156
3-(benzenesulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

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

E694-0156

Molecular Formula

C23H18ClN5O4S (C23 H18 ClN5 O4 S)

Compound Name

3-(benzenesulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

IUPAC name

3-(benzenesulfonyl)-N-(5-chloro-24-dimethoxyphenyl)-[123]triazolo[15-a]quinazolin-5-amine

SMILES

COc(c(Nc(c(cccc1)c1n1nn2)nc1c2S(c1ccccc1)(=O)=O)c1)cc(OC)c1Cl

InChI

InChI=1S/C23H18ClN5O4S/c1-32-19-13-20(33-2)17(12-16(19)24)25-21-15-10-6-7-11-18(15)29-22(26-21)23(27-28-29)34(30,31)14-8-4-3-5-9-14/h3-13H,1-2H3,(H,25,26)

InChI Key

LRVUURXCROHGGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07655081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.95

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.028

Distribution Coefficient, logD

5.028

Water Solubility, LogSw

-5.36

Polar Surface Area

85.858

Acid Dissociation Constant (pKa)

15.64

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

E694-0156 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Dark Chemical Matter Library (18430 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Pool

References: we are preparing a list of scientific research reports with E694-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E694-0156?
Check Price and Availability of E694-0156, 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 E694-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E694-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E694-0156
  • 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 E694-0156 available by request