1502-1537 Screening compound: N~1~-[(Z)-1-[(benzylamino)carbonyl]-2-(1,3-diphenyl-1H-pyrazol-4-yl)-1-ethenyl]-4-bromobenzamide

1502-1537 Screening compound: N~1~-[(Z)-1-[(benzylamino)carbonyl]-2-(1,3-diphenyl-1H-pyrazol-4-yl)-1-ethenyl]-4-bromobenzamide
1502-1537 Screening compound: N~1~-[(Z)-1-[(benzylamino)carbonyl]-2-(1,3-diphenyl-1H-pyrazol-4-yl)-1-ethenyl]-4-bromobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1502-1537
N~1~-[(Z)-1-[(benzylamino)carbonyl]-2-(1,3-diphenyl-1H-pyrazol-4-yl)-1-ethenyl]-4-bromobenzamide

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

1502-1537

Molecular Formula

C32H25BrN4O2 (C32 H25 BrN4 O2)

Compound Name

N~1~-[(Z)-1-[(benzylamino)carbonyl]-2-(1,3-diphenyl-1H-pyrazol-4-yl)-1-ethenyl]-4-bromobenzamide

IUPAC name

(2Z)-N-benzyl-2-[(4-bromophenyl)formamido]-3-(13-diphenyl-1H-pyrazol-4-yl)prop-2-enamide

SMILES

O=C(/C(/NC(c(cc1)ccc1Br)=O)=C/c1cn(-c2ccccc2)nc1-c1ccccc1)NCc1ccccc1

InChI

InChI=1S/C32H25BrN4O2/c33-27-18-16-25(17-19-27)31(38)35-29(32(39)34-21-23-10-4-1-5-11-23)20-26-22-37(28-14-8-3-9-15-28)36-30(26)24-12-6-2-7-13-24/h1-20,22H,21H2,(H,34,39)(H,35,38)

InChI Key

RYFLEROPONPKHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00632506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

577.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.223

Distribution Coefficient, logD

4.903

Water Solubility, LogSw

-6.01

Polar Surface Area

61.209

Acid Dissociation Constant (pKa)

6.10

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.13

1502-1537 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1502-1537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1502-1537?
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What is the minimum amount of 1502-1537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1502-1537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1502-1537
  • 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 1502-1537 available by request