V015-9329 Screening compound: 4-({[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(furan-2-yl)methyl]benzamide

V015-9329 Screening compound: 4-({[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(furan-2-yl)methyl]benzamide
V015-9329 Screening compound: 4-({[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(furan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-9329
4-({[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-[(furan-2-yl)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

V015-9329

Molecular Formula

C29H26N4O3S (C29 H26 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

COc(cccc1)c1-n1c(SCc(cc2)ccc2C(NCc2ccco2)=O)nnc1Cc1ccccc1

InChI

InChI=1S/C29H26N4O3S/c1-35-26-12-6-5-11-25(26)33-27(18-21-8-3-2-4-9-21)31-32-29(33)37-20-22-13-15-23(16-14-22)28(34)30-19-24-10-7-17-36-24/h2-17H,18-20H2,1H3,(H,30,34)

InChI Key

NJDISVNVAUDNHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791839

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

510.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.769

Distribution Coefficient, logD

4.769

Water Solubility, LogSw

-4.59

Polar Surface Area

65.180

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with V015-9329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-9329?
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What is the minimum amount of V015-9329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-9329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-9329
  • 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 V015-9329 available by request