L112-0710 Screening compound: N-(2,6-dimethylphenyl)-2-{[2-(1,2,3,4-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide

L112-0710 Screening compound: N-(2,6-dimethylphenyl)-2-{[2-(1,2,3,4-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide
L112-0710 Screening compound: N-(2,6-dimethylphenyl)-2-{[2-(1,2,3,4-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L112-0710
N-(2,6-dimethylphenyl)-2-{[2-(1,2,3,4-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide

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

L112-0710

Molecular Formula

C27H26N4OS (C27 H26 N4 OS)

Compound Name

N-(2,6-dimethylphenyl)-2-{[2-(1,2,3,4-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide

IUPAC name

N-(26-dimethylphenyl)-2-{[2-(1234-tetrahydroisoquinolin-2-yl)quinazolin-4-yl]sulfanyl}acetamide

SMILES

Cc1cccc(C)c1NC(CSc1nc(N(CC2)Cc3c2cccc3)nc2ccccc12)=O

InChI

InChI=1S/C27H26N4OS/c1-18-8-7-9-19(2)25(18)29-24(32)17-33-26-22-12-5-6-13-23(22)28-27(30-26)31-15-14-20-10-3-4-11-21(20)16-31/h3-13H,14-17H2,1-2H3,(H,29,32)

InChI Key

GFRIEDZOQYXQPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15118825

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.077

Distribution Coefficient, logD

6.073

Water Solubility, LogSw

-5.62

Polar Surface Area

42.180

Acid Dissociation Constant (pKa)

12.29

Base Dissociation Constant (pKb)

5.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

L112-0710 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L112-0710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L112-0710?
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What is the minimum amount of L112-0710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L112-0710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L112-0710
  • 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 L112-0710 available by request