V016-5496 Screening compound: N-butyl-3,5,5-trimethyl-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}hexanamide

V016-5496 Screening compound: N-butyl-3,5,5-trimethyl-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}hexanamide
V016-5496 Screening compound: N-butyl-3,5,5-trimethyl-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5496
N-butyl-3,5,5-trimethyl-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}hexanamide

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

V016-5496

Molecular Formula

C19H33N3O2S (C19 H33 N3 O2 S)

Compound Name

N-butyl-3,5,5-trimethyl-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}hexanamide

IUPAC name

N-butyl-355-trimethyl-N-{[(5-methyl-13-thiazol-2-yl)carbamoyl]methyl}hexanamide

SMILES

CCCCN(CC(Nc1ncc(C)s1)=O)C(CC(C)CC(C)(C)C)=O

InChI

InChI=1S/C19H33N3O2S/c1-7-8-9-22(17(24)10-14(2)11-19(4,5)6)13-16(23)21-18-20-12-15(3)25-18/h12,14H,7-11,13H2,1-6H3,(H,20,21,23)

InChI Key

BCHPQPBNXHHGPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14243779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.326

Distribution Coefficient, logD

5.315

Water Solubility, LogSw

-4.98

Polar Surface Area

49.889

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.68

V016-5496 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V016-5496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5496?
Check Price and Availability of V016-5496, 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 V016-5496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5496
  • 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 V016-5496 available by request