V015-5357 Screening compound: N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide

V015-5357 Screening compound: N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide
V015-5357 Screening compound: N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5357
N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide

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

V015-5357

Molecular Formula

C27H23F3N4O2S (C27 H23 F3 N4 O2 S)

Compound Name

N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide

IUPAC name

N-(5-phenyl-134-thiadiazol-2-yl)-3-[N-(1-phenylethyl)-1-[3-(trifluoromethyl)phenyl]formamido]propanamide

SMILES

CC(c1ccccc1)N(CCC(Nc1nnc(-c2ccccc2)s1)=O)C(c1cc(C(F)(F)F)ccc1)=O

InChI

InChI=1S/C27H23F3N4O2S/c1-18(19-9-4-2-5-10-19)34(25(36)21-13-8-14-22(17-21)27(28,29)30)16-15-23(35)31-26-33-32-24(37-26)20-11-6-3-7-12-20/h2-14,17-18H,15-16H2,1H3,(H,31,33,35)/t18-/m0/s1

InChI Key

XAXUVOIQSUHGFV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19715740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.017

Distribution Coefficient, logD

6.017

Water Solubility, LogSw

-5.64

Polar Surface Area

61.943

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

-3.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.50

V015-5357 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V015-5357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5357?
Check Price and Availability of V015-5357, 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 V015-5357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5357
  • 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 V015-5357 available by request