G603-0049 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine

G603-0049 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine
G603-0049 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G603-0049
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine

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

G603-0049

Molecular Formula

C21H23N3O4S (C21 H23 N3 O4 S)

Compound Name

3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine

IUPAC name

3-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-1-(4-methylbenzenesulfonyl)piperidine

SMILES

Cc(cc1)ccc1S(N(CCC1)CC1c1nc(-c(cc2)ccc2OC)no1)(=O)=O

InChI

InChI=1S/C21H23N3O4S/c1-15-5-11-19(12-6-15)29(25,26)24-13-3-4-17(14-24)21-22-20(23-28-21)16-7-9-18(27-2)10-8-16/h5-12,17H,3-4,13-14H2,1-2H3/t17-/m0/s1

InChI Key

LVLKRGRWKZOCQF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD05711955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.720

Distribution Coefficient, logD

4.720

Water Solubility, LogSw

-4.47

Polar Surface Area

70.832

Acid Dissociation Constant (pKa)

26.18

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G603-0049 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G603-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G603-0049?
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What is the minimum amount of G603-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G603-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G603-0049
  • 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 G603-0049 available by request