8017-1224 Screening compound: 5-(3,4-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine

8017-1224 Screening compound: 5-(3,4-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine
8017-1224 Screening compound: 5-(3,4-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-1224
5-(3,4-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine

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

8017-1224

Molecular Formula

C15H17N3O3S (C15 H17 N3 O3 S)

Compound Name

5-(3,4-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine

IUPAC name

5-(34-dimethoxybenzoyl)-N2-(prop-2-en-1-yl)-13-thiazole-24-diamine

SMILES

COc(ccc(C(c1c(N)nc(NCC=C)s1)=O)c1)c1OC

InChI

InChI=1S/C15H17N3O3S/c1-4-7-17-15-18-14(16)13(22-15)12(19)9-5-6-10(20-2)11(8-9)21-3/h4-6,8H,1,7,16H2,2-3H3,(H,17,18)

InChI Key

ATERQSIXQLCISC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06014249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.519

Distribution Coefficient, logD

2.519

Water Solubility, LogSw

-2.97

Polar Surface Area

70.057

Acid Dissociation Constant (pKa)

17.84

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8017-1224 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8017-1224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-1224?
Check Price and Availability of 8017-1224, 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 8017-1224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-1224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-1224
  • 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 8017-1224 available by request