1270-0176 Screening compound: 1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide

1270-0176 Screening compound: 1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide
1270-0176 Screening compound: 1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1270-0176
1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide

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

1270-0176

Molecular Formula

C25H20BrN5O5 (C25 H20 BrN5 O5)

Compound Name

1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide

IUPAC name

1-{N'-[(3E)-5-bromo-2-oxo-1-[(phenylcarbamoyl)methyl]-23-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}-N-(2-methoxyphenyl)formamide

SMILES

COc(cccc1)c1NC(C(N/N=C(\c(cc(cc1)Br)c1N1CC(Nc2ccccc2)=O)/C1=O)=O)=O

InChI

InChI=1S/C25H20BrN5O5/c1-36-20-10-6-5-9-18(20)28-23(33)24(34)30-29-22-17-13-15(26)11-12-19(17)31(25(22)35)14-21(32)27-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,27,32)(H,28,33)(H,30,34)

InChI Key

BLCANPUARVALDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00784952

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

550.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.719

Distribution Coefficient, logD

1.888

Water Solubility, LogSw

-4.07

Polar Surface Area

103.034

Acid Dissociation Constant (pKa)

5.58

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

1270-0176 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 1270-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1270-0176?
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What is the minimum amount of 1270-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1270-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1270-0176
  • 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 1270-0176 available by request