SA58-0174 Screening compound: N-(3,4-dimethylphenyl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide

SA58-0174 Screening compound: N-(3,4-dimethylphenyl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide
SA58-0174 Screening compound: N-(3,4-dimethylphenyl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA58-0174
N-(3,4-dimethylphenyl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide

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

SA58-0174

Molecular Formula

C18H24N4O2 (C18 H24 N4 O2)

Compound Name

N-(3,4-dimethylphenyl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide

IUPAC name

N-(34-dimethylphenyl)-2-[2-(5-methyl-124-oxadiazol-3-yl)ethyl]pyrrolidine-1-carboxamide

SMILES

Cc1nc(CCC(CCC2)N2C(Nc2cc(C)c(C)cc2)=O)no1

InChI

InChI=1S/C18H24N4O2/c1-12-6-7-15(11-13(12)2)20-18(23)22-10-4-5-16(22)8-9-17-19-14(3)24-21-17/h6-7,11,16H,4-5,8-10H2,1-3H3,(H,20,23)/t16-/m1/s1

InChI Key

MWHQOBCPFWKAJF-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD31999755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.502

Distribution Coefficient, logD

3.502

Water Solubility, LogSw

-3.56

Polar Surface Area

57.616

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

0.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

SA58-0174 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

CNS MPO Library (28609 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with SA58-0174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA58-0174?
Check Price and Availability of SA58-0174, 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 SA58-0174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA58-0174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA58-0174
  • 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 SA58-0174 available by request