6940-0188 Screening compound: N-allyl-N-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine

6940-0188 Screening compound: N-allyl-N-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine
6940-0188 Screening compound: N-allyl-N-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6940-0188
N-allyl-N-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)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

6940-0188

Molecular Formula

C19H22N4S (C19 H22 N4 S)

Compound Name

N-allyl-N-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine

IUPAC name

N-(prop-2-en-1-yl)-8-propyl-11-thia-91416-triazatetracyclo[8.7.0.0^{27}.0^{1217}]heptadeca-1(10)2(7)812(17)1315-hexaen-13-amine

SMILES

CCCc1c(CCCC2)c2c(c2ncnc(NCC=C)c2s2)c2n1

InChI

InChI=1S/C19H22N4S/c1-3-7-14-12-8-5-6-9-13(12)15-16-17(24-19(15)23-14)18(20-10-4-2)22-11-21-16/h4,11H,2-3,5-10H2,1H3,(H,20,21,22)

InChI Key

NKUSKIGSCNEXSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02239914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.265

Distribution Coefficient, logD

5.264

Water Solubility, LogSw

-5.22

Polar Surface Area

42.428

Acid Dissociation Constant (pKa)

17.37

Base Dissociation Constant (pKb)

4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

6940-0188 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 6940-0188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6940-0188?
Check Price and Availability of 6940-0188, 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 6940-0188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6940-0188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6940-0188
  • 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 6940-0188 available by request