E157-0919 Screening compound: N-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide

E157-0919 Screening compound: N-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide
E157-0919 Screening compound: N-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-0919
N-{5-[(4-methylpiperidin-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

E157-0919

Molecular Formula

C13H16N4O4S2 (C13 H16 N4 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

CC(CC1)CCN1S(c1nnc(NC(c2ccco2)=O)s1)(=O)=O

InChI

InChI=1S/C13H16N4O4S2/c1-9-4-6-17(7-5-9)23(19,20)13-16-15-12(22-13)14-11(18)10-3-2-8-21-10/h2-3,8-9H,4-7H2,1H3,(H,14,15,18)

InChI Key

JTTUULXHISAYSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

1.257

Water Solubility, LogSw

-2.85

Polar Surface Area

86.939

Acid Dissociation Constant (pKa)

6.25

Base Dissociation Constant (pKb)

-5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

E157-0919 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with E157-0919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-0919?
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What is the minimum amount of E157-0919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-0919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-0919
  • 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 E157-0919 available by request