D400-6551 Screening compound: 1-[3-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)piperazine

D400-6551 Screening compound: 1-[3-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)piperazine
D400-6551 Screening compound: 1-[3-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D400-6551
1-[3-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)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

D400-6551

Molecular Formula

C24H30N4O5S (C24 H30 N4 O5 S)

Compound Name

1-[3-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)piperazine

IUPAC name

1-[3-(5-tert-butyl-124-oxadiazol-3-yl)-4-methoxybenzenesulfonyl]-4-(2-methoxyphenyl)piperazine

SMILES

CC(C)(C)c1nc(-c(cc(cc2)S(N(CC3)CCN3c(cccc3)c3OC)(=O)=O)c2OC)no1

InChI

InChI=1S/C24H30N4O5S/c1-24(2,3)23-25-22(26-33-23)18-16-17(10-11-20(18)31-4)34(29,30)28-14-12-27(13-15-28)19-8-6-7-9-21(19)32-5/h6-11,16H,12-15H2,1-5H3

InChI Key

VABUFHRWYZXWIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.498

Distribution Coefficient, logD

4.498

Water Solubility, LogSw

-4.39

Polar Surface Area

81.847

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

5.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

D400-6551 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D400-6551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D400-6551?
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What is the minimum amount of D400-6551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D400-6551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D400-6551
  • 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 D400-6551 available by request