8018-2481 Screening compound: (5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one

8018-2481 Screening compound: (5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one
8018-2481 Screening compound: (5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2481
(5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one

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

8018-2481

Molecular Formula

C16H10N6O4S (C16 H10 N6 O4 S)

Compound Name

(5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one

IUPAC name

(5Z)-2-imino-5-[(3-nitrophenyl)methylidene]-3-[4-(1H-pyrrol-1-yl)-125-oxadiazol-3-yl]-13-thiazolidin-4-one

SMILES

N=C(N(c1nonc1-n1cccc1)C1=O)S/C1=C\c1cc([N+]([O-])=O)ccc1

InChI

InChI=1S/C16H10N6O4S/c17-16-21(14-13(18-26-19-14)20-6-1-2-7-20)15(23)12(27-16)9-10-4-3-5-11(8-10)22(24)25/h1-9,17H

InChI Key

HWUZSQXRQWQSFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07657607

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.36

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.499

Distribution Coefficient, logD

3.499

Water Solubility, LogSw

-3.79

Polar Surface Area

106.220

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8018-2481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2481?
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What is the minimum amount of 8018-2481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2481
  • 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 8018-2481 available by request