7276-1689 Screening compound: N-[3-(dimethylamino)propyl]-N-(5-piperidino-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine

7276-1689 Screening compound: N-[3-(dimethylamino)propyl]-N-(5-piperidino-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)amine
7276-1689 Screening compound: N-[3-(dimethylamino)propyl]-N-(5-piperidino-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 7276-1689
N-[3-(dimethylamino)propyl]-N-(5-piperidino-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

7276-1689

Molecular Formula

C23H32N6S (C23 H32 N6 S)

Compound Name

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

IUPAC name

N-[3-(dimethylamino)propyl]-8-(piperidin-1-yl)-11-thia-91416-triazatetracyclo[8.7.0.0^{27}.0^{1217}]heptadeca-1(10)2(7)812(17)1315-hexaen-13-amine

SMILES

CN(C)CCCNc1c2sc3nc(N4CCCCC4)c(CCCC4)c4c3c2ncn1

InChI

InChI=1S/C23H32N6S/c1-28(2)12-8-11-24-21-20-19(25-15-26-21)18-16-9-4-5-10-17(16)22(27-23(18)30-20)29-13-6-3-7-14-29/h15H,3-14H2,1-2H3,(H,24,25,26)

InChI Key

HMEHEHKHBGGCAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03298414

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.61

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.181

Distribution Coefficient, logD

3.245

Water Solubility, LogSw

-4.99

Polar Surface Area

48.413

Acid Dissociation Constant (pKa)

19.21

Base Dissociation Constant (pKb)

9.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.90

7276-1689 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7276-1689 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7276-1689?
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What is the minimum amount of 7276-1689 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7276-1689
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7276-1689
  • 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 7276-1689 available by request