L337-0319 Screening compound: 1-(3,5-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}urea

L337-0319 Screening compound: 1-(3,5-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}urea
L337-0319 Screening compound: 1-(3,5-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L337-0319
1-(3,5-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}urea

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

L337-0319

Molecular Formula

C17H21N5O4S (C17 H21 N5 O4 S)

Compound Name

1-(3,5-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}urea

IUPAC name

1-(35-dimethoxyphenyl)-3-{5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-134-thiadiazol-2-yl}urea

SMILES

COc1cc(NC(Nc2nnc(CC(N3CCCC3)=O)s2)=O)cc(OC)c1

InChI

InChI=1S/C17H21N5O4S/c1-25-12-7-11(8-13(9-12)26-2)18-16(24)19-17-21-20-14(27-17)10-15(23)22-5-3-4-6-22/h7-9H,3-6,10H2,1-2H3,(H2,18,19,21,24)

InChI Key

JHHCKDZSOKVRCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27247088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.788

Distribution Coefficient, logD

2.788

Water Solubility, LogSw

-3.29

Polar Surface Area

88.156

Acid Dissociation Constant (pKa)

10.27

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

L337-0319 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L337-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L337-0319?
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What is the minimum amount of L337-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L337-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L337-0319
  • 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 L337-0319 available by request