8004-5092 Screening compound: N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2-amine

8004-5092 Screening compound: N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2-amine
8004-5092 Screening compound: N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-5092
N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2-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

8004-5092

Molecular Formula

C19H18BrN3O3S2 (C19 H18 BrN3 O3 S2)

Compound Name

N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2-amine

IUPAC name

N-(4-bromophenyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-13-thiazol-2-amine

SMILES

O=S(c(cc1)ccc1-c1csc(Nc(cc2)ccc2Br)n1)(N1CCOCC1)=O

InChI

InChI=1S/C19H18BrN3O3S2/c20-15-3-5-16(6-4-15)21-19-22-18(13-27-19)14-1-7-17(8-2-14)28(24,25)23-9-11-26-12-10-23/h1-8,13H,9-12H2,(H,21,22)

InChI Key

LXWGWRPVONMXEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00745921

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

480.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.228

Distribution Coefficient, logD

5.228

Water Solubility, LogSw

-5.54

Polar Surface Area

58.545

Acid Dissociation Constant (pKa)

18.87

Base Dissociation Constant (pKb)

2.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

8004-5092 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8004-5092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-5092?
Check Price and Availability of 8004-5092, 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 8004-5092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-5092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-5092
  • 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 8004-5092 available by request