V014-4691 Screening compound: 3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide

V014-4691 Screening compound: 3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide
V014-4691 Screening compound: 3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-4691
3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide

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

V014-4691

Molecular Formula

C25H26N4O3S2 (C25 H26 N4 O3 S2)

Compound Name

3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide

IUPAC name

3-methyl-N-[5-(4-methylphenyl)-134-thiadiazol-2-yl]-2-(naphthalene-2-sulfonamido)pentanamide

SMILES

CCC(C)C(C(Nc1nnc(-c2ccc(C)cc2)s1)=O)NS(c1cc2ccccc2cc1)(=O)=O

InChI

InChI=1S/C25H26N4O3S2/c1-4-17(3)22(29-34(31,32)21-14-13-18-7-5-6-8-20(18)15-21)23(30)26-25-28-27-24(33-25)19-11-9-16(2)10-12-19/h5-15,17,22,29H,4H2,1-3H3,(H,26,28,30)

InChI Key

CJBKWXTVZVQIDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20007063

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

494.64

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.121

Distribution Coefficient, logD

6.117

Water Solubility, LogSw

-6.40

Polar Surface Area

87.927

Acid Dissociation Constant (pKa)

9.48

Base Dissociation Constant (pKb)

-3.37

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

24.00

V014-4691 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Others
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V014-4691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-4691?
Check Price and Availability of V014-4691, 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 V014-4691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-4691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-4691
  • 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 V014-4691 available by request