F386-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

F386-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
F386-1647 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F386-1647
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

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

F386-1647

Molecular Formula

C21H16ClN5O4 (C21 H16 ClN5 O4)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-3-[1-(2-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-124-oxadiazole-5-carboxamide

SMILES

Cc(c(-c1noc(C(NCc(cc2)cc3c2OCO3)=O)n1)c1)nn1-c(cccc1)c1Cl

InChI

InChI=1S/C21H16ClN5O4/c1-12-14(10-27(25-12)16-5-3-2-4-15(16)22)19-24-21(31-26-19)20(28)23-9-13-6-7-17-18(8-13)30-11-29-17/h2-8,10H,9,11H2,1H3,(H,23,28)

InChI Key

MKWBVIHASLPPMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14952742

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.457

Distribution Coefficient, logD

3.457

Water Solubility, LogSw

-3.84

Polar Surface Area

87.854

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with F386-1647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F386-1647?
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What is the minimum amount of F386-1647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F386-1647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F386-1647
  • 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 F386-1647 available by request