3683-0479 Screening compound: 2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H,7H,8H,9H-thieno[2,3-c]isoquinolin-1-amine

3683-0479 Screening compound: 2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H,7H,8H,9H-thieno[2,3-c]isoquinolin-1-amine
3683-0479 Screening compound: 2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H,7H,8H,9H-thieno[2,3-c]isoquinolin-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3683-0479
2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H,7H,8H,9H-thieno[2,3-c]isoquinolin-1-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

3683-0479

Molecular Formula

C23H24BrN3OS (C23 H24 BrN3 OS)

Compound Name

2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H,7H,8H,9H-thieno[2,3-c]isoquinolin-1-amine

IUPAC name

2-(4-bromobenzoyl)-5-(piperidin-1-yl)-6H7H8H9H-thieno[23-c]isoquinolin-1-amine

SMILES

Nc1c(C(c(cc2)ccc2Br)=O)sc2c1c(CCCC1)c1c(N1CCCCC1)n2

InChI

InChI=1S/C23H24BrN3OS/c24-15-10-8-14(9-11-15)20(28)21-19(25)18-16-6-2-3-7-17(16)22(26-23(18)29-21)27-12-4-1-5-13-27/h8-11H,1-7,12-13,25H2

InChI Key

VVMSZVGDQNIMCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01565038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.975

Distribution Coefficient, logD

6.974

Water Solubility, LogSw

-6.18

Polar Surface Area

46.118

Acid Dissociation Constant (pKa)

17.85

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with 3683-0479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3683-0479?
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What is the minimum amount of 3683-0479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3683-0479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3683-0479
  • 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 3683-0479 available by request