2932-1056 Screening compound: 1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-2,2,4-trimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydroquinoline

2932-1056 Screening compound: 1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-2,2,4-trimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydroquinoline
2932-1056 Screening compound: 1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-2,2,4-trimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 2932-1056
1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-2,2,4-trimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydroquinoline

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

2932-1056

Molecular Formula

C28H25ClN2O3S (C28 H25 ClN2 O3 S)

Compound Name

1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-2,2,4-trimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydroquinoline

IUPAC name

1-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-224-trimethyl-4-(4-methylphenyl)-1234-tetrahydroquinoline

SMILES

CC(C)(CC1(C)c2ccc(C)cc2)N(C(c(sc2c3ccc([N+]([O-])=O)c2)c3Cl)=O)c2c1cccc2

InChI

InChI=1S/C28H25ClN2O3S/c1-17-9-11-18(12-10-17)28(4)16-27(2,3)30(22-8-6-5-7-21(22)28)26(32)25-24(29)20-14-13-19(31(33)34)15-23(20)35-25/h5-15H,16H2,1-4H3/t28-/m0/s1

InChI Key

PSQHQGCYMSZPJW-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD01796240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

505.04

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.832

Distribution Coefficient, logD

7.832

Water Solubility, LogSw

-6.53

Polar Surface Area

48.181

Acid Dissociation Constant (pKa)

27.15

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

2932-1056 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 2932-1056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2932-1056?
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What is the minimum amount of 2932-1056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2932-1056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2932-1056
  • 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 2932-1056 available by request