D351-0717 Screening compound: 2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

D351-0717 Screening compound: 2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one
D351-0717 Screening compound: 2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D351-0717
2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-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

D351-0717

Molecular Formula

C23H28N4OS (C23 H28 N4 OS)

Compound Name

2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

IUPAC name

2-[2-(4-butyl-35-dimethyl-1H-pyrazol-1-yl)-13-thiazol-4-yl]-1-(1234-tetrahydroisoquinolin-2-yl)ethan-1-one

SMILES

CCCCc1c(C)n(-c2nc(CC(N(CC3)Cc4c3cccc4)=O)cs2)nc1C

InChI

InChI=1S/C23H28N4OS/c1-4-5-10-21-16(2)25-27(17(21)3)23-24-20(15-29-23)13-22(28)26-12-11-18-8-6-7-9-19(18)14-26/h6-9,15H,4-5,10-14H2,1-3H3

InChI Key

RVZOEWVJOQYWQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.207

Distribution Coefficient, logD

5.207

Water Solubility, LogSw

-4.98

Polar Surface Area

40.755

Acid Dissociation Constant (pKa)

19.60

Base Dissociation Constant (pKb)

3.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with D351-0717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D351-0717?
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What is the minimum amount of D351-0717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D351-0717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D351-0717
  • 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 D351-0717 available by request