V012-4926 Screening compound: N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide

V012-4926 Screening compound: N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide
V012-4926 Screening compound: N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-4926
N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide

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

V012-4926

Molecular Formula

C25H25N5O3S2 (C25 H25 N5 O3 S2)

Compound Name

N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide

IUPAC name

N-[4-({[5-(benzylsulfanyl)-4-(4-methylphenyl)-4H-124-triazol-3-yl]methyl}sulfamoyl)phenyl]acetamide

SMILES

CC(Nc(cc1)ccc1S(NCc(n1-c2ccc(C)cc2)nnc1SCc1ccccc1)(=O)=O)=O

InChI

InChI=1S/C25H25N5O3S2/c1-18-8-12-22(13-9-18)30-24(28-29-25(30)34-17-20-6-4-3-5-7-20)16-26-35(32,33)23-14-10-21(11-15-23)27-19(2)31/h3-15,26H,16-17H2,1-2H3,(H,27,31)

InChI Key

XEAKTFSCYQYBRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14239140

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

507.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.591

Distribution Coefficient, logD

3.551

Water Solubility, LogSw

-3.81

Polar Surface Area

90.980

Acid Dissociation Constant (pKa)

8.42

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with V012-4926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-4926?
Check Price and Availability of V012-4926, 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 V012-4926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-4926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-4926
  • 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 V012-4926 available by request