V013-3819 Screening compound: 2-(2H-1,3-benzodioxole-5-amido)-N,N-dipropyl-1,3-thiazole-4-carboxamide

V013-3819 Screening compound: 2-(2H-1,3-benzodioxole-5-amido)-N,N-dipropyl-1,3-thiazole-4-carboxamide
V013-3819 Screening compound: 2-(2H-1,3-benzodioxole-5-amido)-N,N-dipropyl-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-3819
2-(2H-1,3-benzodioxole-5-amido)-N,N-dipropyl-1,3-thiazole-4-carboxamide

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

V013-3819

Molecular Formula

C18H21N3O4S (C18 H21 N3 O4 S)

Compound Name

2-(2H-1,3-benzodioxole-5-amido)-N,N-dipropyl-1,3-thiazole-4-carboxamide

IUPAC name

2-(2H-13-benzodioxole-5-amido)-NN-dipropyl-13-thiazole-4-carboxamide

SMILES

CCCN(CCC)C(c1csc(NC(c(cc2)cc3c2OCO3)=O)n1)=O

InChI

InChI=1S/C18H21N3O4S/c1-3-7-21(8-4-2)17(23)13-10-26-18(19-13)20-16(22)12-5-6-14-15(9-12)25-11-24-14/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,19,20,22)

InChI Key

CPLXFQFROGCXLK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19976198

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

375.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.789

Distribution Coefficient, logD

3.783

Water Solubility, LogSw

-3.91

Polar Surface Area

66.931

Acid Dissociation Constant (pKa)

9.20

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

V013-3819 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with V013-3819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-3819?
Check Price and Availability of V013-3819, 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 V013-3819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-3819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-3819
  • 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 V013-3819 available by request