V024-7945 Screening compound: 4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide

V024-7945 Screening compound: 4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
V024-7945 Screening compound: 4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-7945
4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)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

V024-7945

Molecular Formula

C26H25ClN4O2S (C26 H25 ClN4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(-n2c(SCc(cc3)ccc3C(NCCOC)=O)nnc2-c(cccc2)c2Cl)c1

InChI

InChI=1S/C26H25ClN4O2S/c1-18-6-5-7-21(16-18)31-24(22-8-3-4-9-23(22)27)29-30-26(31)34-17-19-10-12-20(13-11-19)25(32)28-14-15-33-2/h3-13,16H,14-15,17H2,1-2H3,(H,28,32)

InChI Key

SPWNAYQMMORRDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19782766

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

493.03

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.801

Distribution Coefficient, logD

4.801

Water Solubility, LogSw

-4.79

Polar Surface Area

57.581

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.23

References: we are preparing a list of scientific research reports with V024-7945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-7945?
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What is the minimum amount of V024-7945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-7945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-7945
  • 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 V024-7945 available by request