2147-0095 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide

2147-0095 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide
2147-0095 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2147-0095
N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide

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

2147-0095

Molecular Formula

C24H20BrN3O (C24 H20 BrN3 O)

Compound Name

N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide

IUPAC name

N'-[(E)-[1-(4-bromophenyl)-25-dimethyl-1H-pyrrol-3-yl]methylidene]naphthalene-2-carbohydrazide

SMILES

Cc1cc(/C=N/NC(c2cc3ccccc3cc2)=O)c(C)n1-c(cc1)ccc1Br

InChI

InChI=1S/C24H20BrN3O/c1-16-13-21(17(2)28(16)23-11-9-22(25)10-12-23)15-26-27-24(29)20-8-7-18-5-3-4-6-19(18)14-20/h3-15H,1-2H3,(H,27,29)

InChI Key

SCJMSXQGVFDBDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.180

Distribution Coefficient, logD

6.178

Water Solubility, LogSw

-6.49

Polar Surface Area

37.947

Acid Dissociation Constant (pKa)

9.69

Base Dissociation Constant (pKb)

1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 2147-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2147-0095?
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What is the minimum amount of 2147-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2147-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2147-0095
  • 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 2147-0095 available by request