E157-1679 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

E157-1679 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
E157-1679 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-1679
N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-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

E157-1679

Molecular Formula

C17H15ClN6O6S2 (C17 H15 ClN6 O6 S2)

Compound Name

N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

IUPAC name

N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-134-thiadiazol-2-yl)furan-2-carboxamide

SMILES

[O-][N+](c(cc1)cc(Cl)c1N(CC1)CCN1S(c1nnc(NC(c2ccco2)=O)s1)(=O)=O)=O

InChI

InChI=1S/C17H15ClN6O6S2/c18-12-10-11(24(26)27)3-4-13(12)22-5-7-23(8-6-22)32(28,29)17-21-20-16(31-17)19-15(25)14-2-1-9-30-14/h1-4,9-10H,5-8H2,(H,19,20,25)

InChI Key

OULJFLJHCYJAOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.93

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

3.406

Distribution Coefficient, logD

2.223

Water Solubility, LogSw

-3.85

Polar Surface Area

123.280

Acid Dissociation Constant (pKa)

6.25

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with E157-1679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-1679?
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What is the minimum amount of E157-1679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-1679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-1679
  • 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 E157-1679 available by request