E157-1715 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)butanamide

E157-1715 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)butanamide
E157-1715 Screening compound: N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-1715
N-(5-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)butanamide

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

E157-1715

Molecular Formula

C16H19ClN6O5S2 (C16 H19 ClN6 O5 S2)

Compound Name

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

IUPAC name

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

SMILES

CCCC(Nc(s1)nnc1S(N(CC1)CCN1c(ccc([N+]([O-])=O)c1)c1Cl)(=O)=O)=O

InChI

InChI=1S/C16H19ClN6O5S2/c1-2-3-14(24)18-15-19-20-16(29-15)30(27,28)22-8-6-21(7-9-22)13-5-4-11(23(25)26)10-12(13)17/h4-5,10H,2-3,6-9H2,1H3,(H,18,19,24)

InChI Key

NOAMCMUBVXLNQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.95

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.389

Distribution Coefficient, logD

2.919

Water Solubility, LogSw

-3.86

Polar Surface Area

114.759

Acid Dissociation Constant (pKa)

7.11

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with E157-1715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-1715?
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What is the minimum amount of E157-1715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-1715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-1715
  • 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 E157-1715 available by request