C202-1755 Screening compound: 7,7-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H,4H,5H,6H,7H,8H,9H-pyrazolo[3,4-b]quinolin-5-one

C202-1755 Screening compound: 7,7-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H,4H,5H,6H,7H,8H,9H-pyrazolo[3,4-b]quinolin-5-one
C202-1755 Screening compound: 7,7-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H,4H,5H,6H,7H,8H,9H-pyrazolo[3,4-b]quinolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-1755
7,7-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H,4H,5H,6H,7H,8H,9H-pyrazolo[3,4-b]quinolin-5-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

C202-1755

Molecular Formula

C25H24N4O3 (C25 H24 N4 O3)

Compound Name

7,7-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H,4H,5H,6H,7H,8H,9H-pyrazolo[3,4-b]quinolin-5-one

IUPAC name

77-dimethyl-3-(4-methylphenyl)-4-(4-nitrophenyl)-1H4H5H6H7H8H9H-pyrazolo[34-b]quinolin-5-one

SMILES

CC(C)(C1)CC(Nc2c(C3c(cc4)ccc4[N+]([O-])=O)c(-c4ccc(C)cc4)n[nH]2)=C3C1=O

InChI

InChI=1S/C25H24N4O3/c1-14-4-6-16(7-5-14)23-22-20(15-8-10-17(11-9-15)29(31)32)21-18(26-24(22)28-27-23)12-25(2,3)13-19(21)30/h4-11,20H,12-13H2,1-3H3,(H2,26,27,28)/t20-/m0/s1

InChI Key

NCDROPGVNDBYAO-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14730582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.927

Distribution Coefficient, logD

4.926

Water Solubility, LogSw

-4.73

Polar Surface Area

81.487

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-3.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

C202-1755 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C202-1755 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-1755?
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What is the minimum amount of C202-1755 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-1755
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-1755
  • 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 C202-1755 available by request