M317-0038 Screening compound: 1-(4-CHLOROPHENYL)-4-{1-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]-1H-PYRROLE-2-CARBONYL}PIPERAZINE

M317-0038 Screening compound: 1-(4-CHLOROPHENYL)-4-{1-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]-1H-PYRROLE-2-CARBONYL}PIPERAZINE
M317-0038 Screening compound: 1-(4-CHLOROPHENYL)-4-{1-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]-1H-PYRROLE-2-CARBONYL}PIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound M317-0038
1-(4-CHLOROPHENYL)-4-{1-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]-1H-PYRROLE-2-CARBONYL}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

M317-0038

Molecular Formula

C19H20ClN5O2 (C19 H20 ClN5 O2)

Compound Name

1-(4-CHLOROPHENYL)-4-{1-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]-1H-PYRROLE-2-CARBONYL}PIPERAZINE

IUPAC name

n/a

SMILES

Cc1nc(Cn2c(C(N(CC3)CCN3c(cc3)ccc3Cl)=O)ccc2)no1

InChI

InChI=1S/C19H20ClN5O2/c1-14-21-18(22-27-14)13-25-8-2-3-17(25)19(26)24-11-9-23(10-12-24)16-6-4-15(20)5-7-16/h2-8H,9-13H2,1H3

InChI Key

JJQHHCPBZDEPLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.104

Distribution Coefficient, logD

3.104

Water Solubility, LogSw

-3.36

Polar Surface Area

53.904

Acid Dissociation Constant (pKa)

28.08

Base Dissociation Constant (pKb)

5.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

M317-0038 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M317-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M317-0038?
Check Price and Availability of M317-0038, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M317-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M317-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M317-0038
  • 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 M317-0038 available by request