V029-4397 Screening compound: 3,3-dimethyl-N-{2-methyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide

V029-4397 Screening compound: 3,3-dimethyl-N-{2-methyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide
V029-4397 Screening compound: 3,3-dimethyl-N-{2-methyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4397
3,3-dimethyl-N-{2-methyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide

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

V029-4397

Molecular Formula

C22H33N3O5 (C22 H33 N3 O5)

Compound Name

3,3-dimethyl-N-{2-methyl-1-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butyl}butanamide

IUPAC name

33-dimethyl-N-{2-methyl-1-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]butyl}butanamide

SMILES

CCC(C)C(c1nc(-c(cc2OC)cc(OC)c2OC)no1)NC(CC(C)(C)C)=O

InChI

InChI=1S/C22H33N3O5/c1-9-13(2)18(23-17(26)12-22(3,4)5)21-24-20(25-30-21)14-10-15(27-6)19(29-8)16(11-14)28-7/h10-11,13,18H,9,12H2,1-8H3,(H,23,26)

InChI Key

ZHUSQJAEKQHUMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19777646

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.743

Distribution Coefficient, logD

4.743

Water Solubility, LogSw

-4.41

Polar Surface Area

78.717

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

59.10

References: we are preparing a list of scientific research reports with V029-4397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4397?
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What is the minimum amount of V029-4397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4397
  • 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 V029-4397 available by request