1254-0286 Screening compound: 6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one

1254-0286 Screening compound: 6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one
1254-0286 Screening compound: 6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1254-0286
6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one

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

1254-0286

Molecular Formula

C32H23BrClN3O3 (C32 H23 BrClN3 O3)

Compound Name

6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one

IUPAC name

6-bromo-3-[1-(4-chlorobenzoyl)-5-(4-methoxyphenyl)-45-dihydro-1H-pyrazol-3-yl]-4-phenyl-12-dihydroquinolin-2-one

SMILES

COc1ccc(C(C2)N(C(c(cc3)ccc3Cl)=O)N=C2C2=C(c3ccccc3)c(cc(cc3)Br)c3NC2=O)cc1

InChI

InChI=1S/C32H23BrClN3O3/c1-40-24-14-9-19(10-15-24)28-18-27(36-37(28)32(39)21-7-12-23(34)13-8-21)30-29(20-5-3-2-4-6-20)25-17-22(33)11-16-26(25)35-31(30)38/h2-17,28H,18H2,1H3,(H,35,38)/t28-/m1/s1

InChI Key

MSXQBLGGKDNBLS-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD01245048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

612.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.582

Distribution Coefficient, logD

7.544

Water Solubility, LogSw

-6.38

Polar Surface Area

59.264

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-4.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.40

References: we are preparing a list of scientific research reports with 1254-0286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1254-0286?
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What is the minimum amount of 1254-0286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1254-0286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1254-0286
  • 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 1254-0286 available by request