6233-0415 Screening compound: 2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

6233-0415 Screening compound: 2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
6233-0415 Screening compound: 2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 6233-0415
2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

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

6233-0415

Molecular Formula

C14H12BrN3S (C14 H12 BrN3 S)

Compound Name

2-amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

IUPAC name

2-amino-4-(5-bromothiophen-2-yl)-5678-tetrahydroquinoline-3-carbonitrile

SMILES

Nc1nc(CCCC2)c2c(-c(s2)ccc2Br)c1C#N

InChI

InChI=1S/C14H12BrN3S/c15-12-6-5-11(19-12)13-8-3-1-2-4-10(8)18-14(17)9(13)7-16/h5-6H,1-4H2,(H2,17,18)

InChI Key

NNOXETWBPUKXET-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04026643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.24

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.044

Distribution Coefficient, logD

4.040

Water Solubility, LogSw

-4.58

Polar Surface Area

48.775

Acid Dissociation Constant (pKa)

18.76

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

6233-0415 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Dark Chemical Matter Library (18430 compounds)

GABA Library (7115 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Eye
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • GPCR
  • Ion Channels
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands
Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6233-0415 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6233-0415?
Check Price and Availability of 6233-0415, 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 6233-0415 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6233-0415
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6233-0415
  • 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 6233-0415 available by request