1612-1015 Screening compound: N'-[(2E)-3-(1H-1,3-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide

1612-1015 Screening compound: N'-[(2E)-3-(1H-1,3-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide
1612-1015 Screening compound: N'-[(2E)-3-(1H-1,3-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1612-1015
N'-[(2E)-3-(1H-1,3-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide

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

1612-1015

Molecular Formula

C24H17BrN4O3 (C24 H17 BrN4 O3)

Compound Name

N'-[(2E)-3-(1H-1,3-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide

IUPAC name

N'-[(2E)-3-(1H-13-benzodiazol-2-yl)-6-bromo-2H-chromen-2-ylidene]-2-methoxybenzohydrazide

SMILES

COc(cccc1)c1C(N/N=C1/Oc(ccc(Br)c2)c2C=C1c1nc(cccc2)c2[nH]1)=O

InChI

InChI=1S/C24H17BrN4O3/c1-31-21-9-5-2-6-16(21)23(30)28-29-24-17(13-14-12-15(25)10-11-20(14)32-24)22-26-18-7-3-4-8-19(18)27-22/h2-13H,1H3,(H,26,27)(H,28,30)

InChI Key

ZEYSXJYUSKCXOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01839073

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.628

Distribution Coefficient, logD

4.547

Water Solubility, LogSw

-4.61

Polar Surface Area

69.742

Acid Dissociation Constant (pKa)

8.09

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

1612-1015 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1612-1015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1612-1015?
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What is the minimum amount of 1612-1015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1612-1015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1612-1015
  • 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 1612-1015 available by request