V026-7491 Screening compound: 4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole

V026-7491 Screening compound: 4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
V026-7491 Screening compound: 4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-7491
4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole

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

V026-7491

Molecular Formula

C24H28N4OS (C24 H28 N4 OS)

Compound Name

4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole

IUPAC name

4-(3-methylphenyl)-3-(propan-2-yl)-5-({[2-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)-4H-124-triazole

SMILES

CC(C)c(n1-c2cc(C)ccc2)nnc1SCc(cccc1)c1C(N1CCCC1)=O

InChI

InChI=1S/C24H28N4OS/c1-17(2)22-25-26-24(28(22)20-11-8-9-18(3)15-20)30-16-19-10-4-5-12-21(19)23(29)27-13-6-7-14-27/h4-5,8-12,15,17H,6-7,13-14,16H2,1-3H3

InChI Key

BTKDPPLVKULNEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27631979

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.000

Distribution Coefficient, logD

5.000

Water Solubility, LogSw

-4.61

Polar Surface Area

41.998

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with V026-7491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-7491?
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What is the minimum amount of V026-7491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-7491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-7491
  • 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 V026-7491 available by request