V017-5732 Screening compound: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide

V017-5732 Screening compound: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide
V017-5732 Screening compound: N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-5732
N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide

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

V017-5732

Molecular Formula

C25H20FN5O4S (C25 H20 FN5 O4 S)

Compound Name

N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide

IUPAC name

N-[5-(4-fluorophenyl)-134-thiadiazol-2-yl]-2-[(4-methyl-3-nitrophenyl)formamido]-3-phenylpropanamide

SMILES

Cc(ccc(C(NC(Cc1ccccc1)C(Nc1nnc(-c(cc2)ccc2F)s1)=O)=O)c1)c1[N+]([O-])=O

InChI

InChI=1S/C25H20FN5O4S/c1-15-7-8-18(14-21(15)31(34)35)22(32)27-20(13-16-5-3-2-4-6-16)23(33)28-25-30-29-24(36-25)17-9-11-19(26)12-10-17/h2-12,14,20H,13H2,1H3,(H,27,32)(H,28,30,33)/t20-/m0/s1

InChI Key

RAKFOWKBYQSOTL-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14243023

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

505.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.208

Distribution Coefficient, logD

5.208

Water Solubility, LogSw

-5.09

Polar Surface Area

103.727

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

-4.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.00

V017-5732 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V017-5732 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-5732?
Check Price and Availability of V017-5732, 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 V017-5732 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-5732
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-5732
  • 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 V017-5732 available by request