V014-5087 Screening compound: N-(4-{2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,2-dimethylpropanamide

V014-5087 Screening compound: N-(4-{2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,2-dimethylpropanamide
V014-5087 Screening compound: N-(4-{2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5087
N-(4-{2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,2-dimethylpropanamide

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

V014-5087

Molecular Formula

C21H23N3O2S (C21 H23 N3 O2 S)

Compound Name

N-(4-{2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,2-dimethylpropanamide

IUPAC name

N-(4-{2-[(3-methoxyphenyl)amino]-13-thiazol-4-yl}phenyl)-22-dimethylpropanamide

SMILES

CC(C)(C)C(Nc(cc1)ccc1-c1csc(Nc2cc(OC)ccc2)n1)=O

InChI

InChI=1S/C21H23N3O2S/c1-21(2,3)19(25)22-15-10-8-14(9-11-15)18-13-27-20(24-18)23-16-6-5-7-17(12-16)26-4/h5-13H,1-4H3,(H,22,25)(H,23,24)

InChI Key

KCFSTWMSTKOYQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10461357

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.775

Distribution Coefficient, logD

5.775

Water Solubility, LogSw

-5.54

Polar Surface Area

49.832

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V014-5087 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with V014-5087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5087?
Check Price and Availability of V014-5087, 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 V014-5087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5087
  • 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 V014-5087 available by request