V014-9196 Screening compound: N-(1-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide

V014-9196 Screening compound: N-(1-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide
V014-9196 Screening compound: N-(1-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-9196
N-(1-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide

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

V014-9196

Molecular Formula

C26H32N4O3S (C26 H32 N4 O3 S)

Compound Name

N-(1-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide

IUPAC name

N-(1-{[5-(3-methoxyphenyl)-134-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)octanamide

SMILES

CCCCCCCC(NC(Cc1ccccc1)C(Nc1nnc(-c2cc(OC)ccc2)s1)=O)=O

InChI

InChI=1S/C26H32N4O3S/c1-3-4-5-6-10-16-23(31)27-22(17-19-12-8-7-9-13-19)24(32)28-26-30-29-25(34-26)20-14-11-15-21(18-20)33-2/h7-9,11-15,18,22H,3-6,10,16-17H2,1-2H3,(H,27,31)(H,28,30,32)/t22-/m0/s1

InChI Key

NHFZVGDBFBHOBS-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14241980

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.228

Distribution Coefficient, logD

6.227

Water Solubility, LogSw

-5.33

Polar Surface Area

78.249

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

V014-9196 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V014-9196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-9196?
Check Price and Availability of V014-9196, 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 V014-9196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-9196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-9196
  • 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 V014-9196 available by request