2180-0024 Screening compound: 4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]butanehydrazide

2180-0024 Screening compound: 4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]butanehydrazide
2180-0024 Screening compound: 4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]butanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2180-0024
4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]butanehydrazide

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

2180-0024

Molecular Formula

C19H17ClN4O5 (C19 H17 ClN4 O5)

Compound Name

4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]butanehydrazide

IUPAC name

4-(4-chloro-2-methylphenoxy)-N'-[(3E)-5-nitro-2-oxo-23-dihydro-1H-indol-3-ylidene]butanehydrazide

SMILES

Cc(cc(cc1)Cl)c1OCCCC(N/N=C(\c(cc(cc1)[N+]([O-])=O)c1N1)/C1=O)=O

InChI

InChI=1S/C19H17ClN4O5/c1-11-9-12(20)4-7-16(11)29-8-2-3-17(25)22-23-18-14-10-13(24(27)28)5-6-15(14)21-19(18)26/h4-7,9-10H,2-3,8H2,1H3,(H,22,25)(H,21,23,26)

InChI Key

GXHQWQQVBMVSSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01537749

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.82

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.107

Distribution Coefficient, logD

4.096

Water Solubility, LogSw

-4.52

Polar Surface Area

100.037

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with 2180-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2180-0024?
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What is the minimum amount of 2180-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2180-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2180-0024
  • 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 2180-0024 available by request