V029-5557 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide

V029-5557 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
V029-5557 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-5557
N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-N-{2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}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

V029-5557

Molecular Formula

C29H39N3O7 (C29 H39 N3 O7)

Compound Name

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

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-33-dimethyl-N-{2-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}butanamide

SMILES

CC(C)(C)CC(N(CCc1nc(-c(cc2OC)cc(OC)c2OC)no1)CCc(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C29H39N3O7/c1-29(2,3)18-26(33)32(13-11-19-9-10-21(34-4)22(15-19)35-5)14-12-25-30-28(31-39-25)20-16-23(36-6)27(38-8)24(17-20)37-7/h9-10,15-17H,11-14,18H2,1-8H3

InChI Key

LGEZVYBQINGHQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19782057

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

541.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.515

Distribution Coefficient, logD

4.515

Water Solubility, LogSw

-4.48

Polar Surface Area

85.461

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

-0.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

References: we are preparing a list of scientific research reports with V029-5557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-5557?
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What is the minimum amount of V029-5557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-5557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-5557
  • 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 V029-5557 available by request