4469-0736 Screening compound: N-(3-CHLORO-2-METHYLPHENYL)-4-(3,4-DIMETHOXYPHENYL)-1,3-THIAZOL-2-AMINE

4469-0736 Screening compound: N-(3-CHLORO-2-METHYLPHENYL)-4-(3,4-DIMETHOXYPHENYL)-1,3-THIAZOL-2-AMINE
4469-0736 Screening compound: N-(3-CHLORO-2-METHYLPHENYL)-4-(3,4-DIMETHOXYPHENYL)-1,3-THIAZOL-2-AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4469-0736
N-(3-CHLORO-2-METHYLPHENYL)-4-(3,4-DIMETHOXYPHENYL)-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

4469-0736

Molecular Formula

C18H17ClN2O2S (C18 H17 ClN2 O2 S)

Compound Name

N-(3-CHLORO-2-METHYLPHENYL)-4-(3,4-DIMETHOXYPHENYL)-1,3-THIAZOL-2-AMINE

IUPAC name

n/a

SMILES

Cc(c(Nc1nc(-c(cc2)cc(OC)c2OC)cs1)ccc1)c1Cl

InChI

InChI=1S/C18H17ClN2O2S/c1-11-13(19)5-4-6-14(11)20-18-21-15(10-24-18)12-7-8-16(22-2)17(9-12)23-3/h4-10H,1-3H3,(H,20,21)

InChI Key

CCBJTMDJSVRGAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03017326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.853

Distribution Coefficient, logD

5.853

Water Solubility, LogSw

-6.24

Polar Surface Area

33.489

Acid Dissociation Constant (pKa)

18.55

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

4469-0736 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4469-0736 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4469-0736?
Check Price and Availability of 4469-0736, 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 4469-0736 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4469-0736
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4469-0736
  • 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 4469-0736 available by request