8014-9718 Screening compound: 5,7-dipropyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

8014-9718 Screening compound: 5,7-dipropyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
8014-9718 Screening compound: 5,7-dipropyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9718
5,7-dipropyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

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

8014-9718

Molecular Formula

C18H26N2OS (C18 H26 N2 OS)

Compound Name

5,7-dipropyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

IUPAC name

57-dipropyl-2-(thiophen-2-yl)-13-diazatricyclo[3.3.1.1^{37}]decan-6-one

SMILES

CCCC(C1)(CN2C(c3cccs3)N1CC1(CCC)C2)C1=O

InChI

InChI=1S/C18H26N2OS/c1-3-7-17-10-19-12-18(8-4-2,16(17)21)13-20(11-17)15(19)14-6-5-9-22-14/h5-6,9,15H,3-4,7-8,10-13H2,1-2H3

InChI Key

QOJZDITVVRYCFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03273422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.750

Distribution Coefficient, logD

3.750

Water Solubility, LogSw

-3.79

Polar Surface Area

20.936

Acid Dissociation Constant (pKa)

26.55

Base Dissociation Constant (pKb)

3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.22

References: we are preparing a list of scientific research reports with 8014-9718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9718?
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What is the minimum amount of 8014-9718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9718
  • 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 8014-9718 available by request