P074-3079 Screening compound: N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-1,3,4-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide

P074-3079 Screening compound: N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-1,3,4-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide
P074-3079 Screening compound: N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-1,3,4-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P074-3079
N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-1,3,4-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide

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

P074-3079

Molecular Formula

C20H22N4O2S2 (C20 H22 N4 O2 S2)

Compound Name

N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-1,3,4-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide

IUPAC name

N-{2-phenyl-1-[5-(thiomorpholin-4-yl)-134-oxadiazol-2-yl]ethyl}-2-(thiophen-2-yl)acetamide

SMILES

O=C(Cc1cccs1)NC(Cc1ccccc1)c1nnc(N2CCSCC2)o1

InChI

InChI=1S/C20H22N4O2S2/c25-18(14-16-7-4-10-28-16)21-17(13-15-5-2-1-3-6-15)19-22-23-20(26-19)24-8-11-27-12-9-24/h1-7,10,17H,8-9,11-14H2,(H,21,25)/t17-/m0/s1

InChI Key

IOGJSYUHIVUYER-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27562697

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.350

Distribution Coefficient, logD

2.350

Water Solubility, LogSw

-2.68

Polar Surface Area

59.127

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

6.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

P074-3079 in Drug Discovery

Included in Screening Libraries

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

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with P074-3079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P074-3079?
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What is the minimum amount of P074-3079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P074-3079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P074-3079
  • 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 P074-3079 available by request