E735-0072 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzamide

E735-0072 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzamide
E735-0072 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E735-0072
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)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

E735-0072

Molecular Formula

C23H23N7O (C23 H23 N7 O)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl}amino)benzamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-3-({[1234]tetrazolo[15-a]quinoxalin-4-yl}amino)benzamide

SMILES

O=C(c1cc(Nc2nc(cccc3)c3n3nnnc23)ccc1)NCCC1=CCCCC1

InChI

InChI=1S/C23H23N7O/c31-23(24-14-13-16-7-2-1-3-8-16)17-9-6-10-18(15-17)25-21-22-27-28-29-30(22)20-12-5-4-11-19(20)26-21/h4-7,9-12,15H,1-3,8,13-14H2,(H,24,31)(H,25,26)

InChI Key

CUACVVDWQAFNSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.865

Distribution Coefficient, logD

3.865

Water Solubility, LogSw

-4.10

Polar Surface Area

78.824

Acid Dissociation Constant (pKa)

13.91

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

E735-0072 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

C-Met Library (15277 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cardiovascular
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E735-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E735-0072?
Check Price and Availability of E735-0072, 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 E735-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E735-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E735-0072
  • 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 E735-0072 available by request