3720-2434 Screening compound: (2E)-3-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl}prop-2-enoic acid

3720-2434 Screening compound: (2E)-3-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl}prop-2-enoic acid
3720-2434 Screening compound: (2E)-3-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl}prop-2-enoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3720-2434
(2E)-3-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl}prop-2-enoic acid

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

3720-2434

Molecular Formula

C14H12N2O4S (C14 H12 N2 O4 S)

Compound Name

(2E)-3-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl}prop-2-enoic acid

IUPAC name

(2E)-3-{[4-(4-methoxyphenyl)-13-thiazol-2-yl]carbamoyl}prop-2-enoic acid

SMILES

COc(cc1)ccc1-c1csc(NC(/C=C/C(O)=O)=O)n1

InChI

InChI=1S/C14H12N2O4S/c1-20-10-4-2-9(3-5-10)11-8-21-14(15-11)16-12(17)6-7-13(18)19/h2-8H,1H3,(H,18,19)(H,15,16,17)

InChI Key

NAIAOWDQMQXRQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01240437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.212

Distribution Coefficient, logD

-1.246

Water Solubility, LogSw

-3.49

Polar Surface Area

69.090

Acid Dissociation Constant (pKa)

2.94

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

3720-2434 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

SmartTM Library (51161 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 3720-2434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3720-2434?
Check Price and Availability of 3720-2434, 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 3720-2434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3720-2434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3720-2434
  • 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 3720-2434 available by request