1072-0156 Screening compound: 2-methoxy-N-({N'-[(E)-(2,4,6-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide

1072-0156 Screening compound: 2-methoxy-N-({N'-[(E)-(2,4,6-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide
1072-0156 Screening compound: 2-methoxy-N-({N'-[(E)-(2,4,6-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1072-0156
2-methoxy-N-({N'-[(E)-(2,4,6-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide

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

1072-0156

Molecular Formula

C17H14Br3N3O4 (C17 H14 Br3 N3 O4)

Compound Name

2-methoxy-N-({N'-[(E)-(2,4,6-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide

IUPAC name

2-methoxy-N-({N'-[(E)-(246-tribromo-3-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)benzamide

SMILES

COc(cccc1)c1C(NCC(N/N=C/c(c(Br)c(c(Br)c1)O)c1Br)=O)=O

InChI

InChI=1S/C17H14Br3N3O4/c1-27-13-5-3-2-4-9(13)17(26)21-8-14(24)23-22-7-10-11(18)6-12(19)16(25)15(10)20/h2-7,25H,8H2,1H3,(H,21,26)(H,23,24)

InChI Key

YZDUWONNMWZNFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00806912

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

564.03

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.959

Distribution Coefficient, logD

4.484

Water Solubility, LogSw

-4.47

Polar Surface Area

83.135

Acid Dissociation Constant (pKa)

7.10

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

1072-0156 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1072-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1072-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1072-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1072-0156
  • 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 1072-0156 available by request