V025-4501 Screening compound: N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide

V025-4501 Screening compound: N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
V025-4501 Screening compound: N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-4501
N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide

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

V025-4501

Molecular Formula

C29H25N5O2S (C29 H25 N5 O2 S)

Compound Name

N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide

IUPAC name

N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-124-triazol-3-yl]sulfanyl}methyl)benzamide

SMILES

Cc(cccc1)c1-n1c(SCc(cc2)ccc2C(Nc(cc2)ccc2OC)=O)nnc1-c1ccncc1

InChI

InChI=1S/C29H25N5O2S/c1-20-5-3-4-6-26(20)34-27(22-15-17-30-18-16-22)32-33-29(34)37-19-21-7-9-23(10-8-21)28(35)31-24-11-13-25(36-2)14-12-24/h3-18H,19H2,1-2H3,(H,31,35)

InChI Key

VGCSAGPMEOBLKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19782026

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

507.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.036

Distribution Coefficient, logD

5.035

Water Solubility, LogSw

-4.45

Polar Surface Area

64.475

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

3.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.30

References: we are preparing a list of scientific research reports with V025-4501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-4501?
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What is the minimum amount of V025-4501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-4501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-4501
  • 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 V025-4501 available by request