L674-0717 Screening compound: N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-1,2'-quinoxalin]-3'-amine

L674-0717 Screening compound: N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-1,2'-quinoxalin]-3'-amine
L674-0717 Screening compound: N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-1,2'-quinoxalin]-3'-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound L674-0717
N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-1,2'-quinoxalin]-3'-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

L674-0717

Molecular Formula

C22H27N3 (C22 H27 N3)

Compound Name

N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-1,2'-quinoxalin]-3'-amine

IUPAC name

N-[(3-methylphenyl)methyl]-1'H-spiro[cycloheptane-12'-quinoxalin]-3'-amine

SMILES

Cc1cccc(CNC2=Nc(cccc3)c3NC22CCCCCC2)c1

InChI

InChI=1S/C22H27N3/c1-17-9-8-10-18(15-17)16-23-21-22(13-6-2-3-7-14-22)25-20-12-5-4-11-19(20)24-21/h4-5,8-12,15,25H,2-3,6-7,13-14,16H2,1H3,(H,23,24)

InChI Key

KJUHAAXEGDTGPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133116

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

333.48

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-4.95

Polar Surface Area

32.560

Acid Dissociation Constant (pKa)

14.29

Base Dissociation Constant (pKb)

3.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

L674-0717 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L674-0717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L674-0717?
Check Price and Availability of L674-0717, 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 L674-0717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L674-0717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L674-0717
  • 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 L674-0717 available by request