V011-9253 Screening compound: N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}dodecanamide

V011-9253 Screening compound: N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}dodecanamide
V011-9253 Screening compound: N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}dodecanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-9253
N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}dodecanamide

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

V011-9253

Molecular Formula

C31H42N4O5 (C31 H42 N4 O5)

Compound Name

N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}dodecanamide

IUPAC name

N-{4-[5-(2H-13-benzodioxol-5-yl)-3-(2-ethoxyethoxy)-1H-124-triazol-1-yl]phenyl}dodecanamide

SMILES

CCCCCCCCCCCC(Nc(cc1)ccc1-n(c(-c(cc1)cc2c1OCO2)n1)nc1OCCOCC)=O

InChI

InChI=1S/C31H42N4O5/c1-3-5-6-7-8-9-10-11-12-13-29(36)32-25-15-17-26(18-16-25)35-30(33-31(34-35)38-21-20-37-4-2)24-14-19-27-28(22-24)40-23-39-27/h14-19,22H,3-13,20-21,23H2,1-2H3,(H,32,36)

InChI Key

DSBWIBPEBSWVLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19758085

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

550.7

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

7.995

Distribution Coefficient, logD

7.995

Water Solubility, LogSw

-5.64

Polar Surface Area

79.350

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.60

References: we are preparing a list of scientific research reports with V011-9253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-9253?
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What is the minimum amount of V011-9253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-9253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-9253
  • 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 V011-9253 available by request