V013-4838 Screening compound: 1-({3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine

V013-4838 Screening compound: 1-({3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine
V013-4838 Screening compound: 1-({3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-4838
1-({3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine

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

V013-4838

Molecular Formula

C27H24ClFN4O3 (C27 H24 ClFN4 O3)

Compound Name

1-({3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine

IUPAC name

1-({3-[5-(3-chlorophenyl)-124-oxadiazol-3-yl]phenyl}methyl)-4-(4-fluoro-3-methoxybenzoyl)piperazine

SMILES

COc(cc(cc1)C(N2CCN(Cc3cccc(-c4noc(-c5cccc(Cl)c5)n4)c3)CC2)=O)c1F

InChI

InChI=1S/C27H24ClFN4O3/c1-35-24-16-21(8-9-23(24)29)27(34)33-12-10-32(11-13-33)17-18-4-2-5-19(14-18)25-30-26(36-31-25)20-6-3-7-22(28)15-20/h2-9,14-16H,10-13,17H2,1H3

InChI Key

XILKOPFNXBLXDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19962240

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

506.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.057

Distribution Coefficient, logD

5.056

Water Solubility, LogSw

-5.31

Polar Surface Area

59.463

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V013-4838 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-4838?
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What is the minimum amount of V013-4838 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-4838
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-4838
  • 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 V013-4838 available by request