L063-0053 Screening compound: N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-1,3,4-thiadiazole-2-carboxamide

L063-0053 Screening compound: N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-1,3,4-thiadiazole-2-carboxamide
L063-0053 Screening compound: N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L063-0053
N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-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

L063-0053

Molecular Formula

C19H18FN5O4S2 (C19 H18 FN5 O4 S2)

Compound Name

N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(4-fluorophenyl)-5-[(4-propanamidobenzenesulfonamido)methyl]-134-thiadiazole-2-carboxamide

SMILES

CCC(Nc(cc1)ccc1S(NCc1nnc(C(Nc(cc2)ccc2F)=O)s1)(=O)=O)=O

InChI

InChI=1S/C19H18FN5O4S2/c1-2-16(26)22-13-7-9-15(10-8-13)31(28,29)21-11-17-24-25-19(30-17)18(27)23-14-5-3-12(20)4-6-14/h3-10,21H,2,11H2,1H3,(H,22,26)(H,23,27)

InChI Key

JMPUMQARDIXAEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27228153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.441

Distribution Coefficient, logD

2.253

Water Solubility, LogSw

-2.99

Polar Surface Area

112.237

Acid Dissociation Constant (pKa)

7.67

Base Dissociation Constant (pKb)

-1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with L063-0053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L063-0053?
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What is the minimum amount of L063-0053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L063-0053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L063-0053
  • 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 L063-0053 available by request