5633-3541 Screening compound: (5Z)-5-(phenylmethylidene)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-4,5-dihydro-1,3-thiazol-4-one

5633-3541 Screening compound: (5Z)-5-(phenylmethylidene)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-4,5-dihydro-1,3-thiazol-4-one
5633-3541 Screening compound: (5Z)-5-(phenylmethylidene)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-4,5-dihydro-1,3-thiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5633-3541
(5Z)-5-(phenylmethylidene)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-4,5-dihydro-1,3-thiazol-4-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

5633-3541

Molecular Formula

C19H16N2OS (C19 H16 N2 OS)

Compound Name

(5Z)-5-(phenylmethylidene)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-4,5-dihydro-1,3-thiazol-4-one

IUPAC name

(5Z)-5-(phenylmethylidene)-2-(1234-tetrahydroisoquinolin-2-yl)-45-dihydro-13-thiazol-4-one

SMILES

O=C1N=C(N(CC2)Cc3c2cccc3)S/C1=C\c1ccccc1

InChI

InChI=1S/C19H16N2OS/c22-18-17(12-14-6-2-1-3-7-14)23-19(20-18)21-11-10-15-8-4-5-9-16(15)13-21/h1-9,12H,10-11,13H2

InChI Key

GAHSXWJRAXSBGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03690611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.006

Distribution Coefficient, logD

4.006

Water Solubility, LogSw

-4.19

Polar Surface Area

25.257

Acid Dissociation Constant (pKa)

26.07

Base Dissociation Constant (pKb)

3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 5633-3541 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5633-3541?
Check Price and Availability of 5633-3541, 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 5633-3541 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5633-3541
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5633-3541
  • 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 5633-3541 available by request