L076-0677 Screening compound: 5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

L076-0677 Screening compound: 5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
L076-0677 Screening compound: 5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L076-0677
5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-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

L076-0677

Molecular Formula

C23H24N4O3S (C23 H24 N4 O3 S)

Compound Name

5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[1-(2-ethoxybenzoyl)piperidin-4-yl]-N-phenyl-134-thiadiazole-2-carboxamide

SMILES

CCOc(cccc1)c1C(N(CC1)CCC1c1nnc(C(Nc2ccccc2)=O)s1)=O

InChI

InChI=1S/C23H24N4O3S/c1-2-30-19-11-7-6-10-18(19)23(29)27-14-12-16(13-15-27)21-25-26-22(31-21)20(28)24-17-8-4-3-5-9-17/h3-11,16H,2,12-15H2,1H3,(H,24,28)

InChI Key

RTEGXRWPUOUZLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27229098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.259

Distribution Coefficient, logD

3.259

Water Solubility, LogSw

-3.68

Polar Surface Area

70.421

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

L076-0677 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 L076-0677 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L076-0677?
Check Price and Availability of L076-0677, 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 L076-0677 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L076-0677
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L076-0677
  • 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 L076-0677 available by request