L949-1314 Screening compound: 2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4-dimethoxyphenyl)pyrrolidine-1-carboxamide

L949-1314 Screening compound: 2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4-dimethoxyphenyl)pyrrolidine-1-carboxamide
L949-1314 Screening compound: 2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4-dimethoxyphenyl)pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L949-1314
2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4-dimethoxyphenyl)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

L949-1314

Molecular Formula

C21H21ClN4O4 (C21 H21 ClN4 O4)

Compound Name

2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4-dimethoxyphenyl)pyrrolidine-1-carboxamide

IUPAC name

2-[3-(3-chlorophenyl)-124-oxadiazol-5-yl]-N-(24-dimethoxyphenyl)pyrrolidine-1-carboxamide

SMILES

COc(cc1)cc(OC)c1NC(N(CCC1)C1c1nc(-c2cccc(Cl)c2)no1)=O

InChI

InChI=1S/C21H21ClN4O4/c1-28-15-8-9-16(18(12-15)29-2)23-21(27)26-10-4-7-17(26)20-24-19(25-30-20)13-5-3-6-14(22)11-13/h3,5-6,8-9,11-12,17H,4,7,10H2,1-2H3,(H,23,27)/t17-/m0/s1

InChI Key

BAMMJQXMIZCNLO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27489272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.967

Distribution Coefficient, logD

4.967

Water Solubility, LogSw

-5.14

Polar Surface Area

71.650

Acid Dissociation Constant (pKa)

12.76

Base Dissociation Constant (pKb)

0.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

L949-1314 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L949-1314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L949-1314?
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What is the minimum amount of L949-1314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L949-1314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L949-1314
  • 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 L949-1314 available by request