L078-0227 Screening compound: N-(3-fluorophenyl)-5-[1-(4-propylbenzenesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide

L078-0227 Screening compound: N-(3-fluorophenyl)-5-[1-(4-propylbenzenesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
L078-0227 Screening compound: N-(3-fluorophenyl)-5-[1-(4-propylbenzenesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L078-0227
N-(3-fluorophenyl)-5-[1-(4-propylbenzenesulfonyl)piperidin-4-yl]-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

L078-0227

Molecular Formula

C23H25FN4O3S2 (C23 H25 FN4 O3 S2)

Compound Name

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

IUPAC name

N-(3-fluorophenyl)-5-[1-(4-propylbenzenesulfonyl)piperidin-4-yl]-134-thiadiazole-2-carboxamide

SMILES

CCCc(cc1)ccc1S(N(CC1)CCC1c1nnc(C(Nc2cc(F)ccc2)=O)s1)(=O)=O

InChI

InChI=1S/C23H25FN4O3S2/c1-2-4-16-7-9-20(10-8-16)33(30,31)28-13-11-17(12-14-28)22-26-27-23(32-22)21(29)25-19-6-3-5-18(24)15-19/h3,5-10,15,17H,2,4,11-14H2,1H3,(H,25,29)

InChI Key

FUUXVOFWCQEBHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15118144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.002

Distribution Coefficient, logD

4.998

Water Solubility, LogSw

-4.61

Polar Surface Area

78.273

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with L078-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L078-0227?
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What is the minimum amount of L078-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L078-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L078-0227
  • 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 L078-0227 available by request