C660-0526 Screening compound: 2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

C660-0526 Screening compound: 2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
C660-0526 Screening compound: 2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0526
2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

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

C660-0526

Molecular Formula

C21H26N2O2S (C21 H26 N2 O2 S)

Compound Name

2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

IUPAC name

2-(2-methylpropyl)-1-oxo-N-propyl-3-(thiophen-2-yl)-1234-tetrahydroisoquinoline-4-carboxamide

SMILES

CCCNC(C(C(c1cccs1)N1CC(C)C)c(cccc2)c2C1=O)=O

InChI

InChI=1S/C21H26N2O2S/c1-4-11-22-20(24)18-15-8-5-6-9-16(15)21(25)23(13-14(2)3)19(18)17-10-7-12-26-17/h5-10,12,14,18-19H,4,11,13H2,1-3H3,(H,22,24)

InChI Key

HZSKYSWJICNDIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.712

Distribution Coefficient, logD

3.712

Water Solubility, LogSw

-3.92

Polar Surface Area

41.467

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

-0.18

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.90

C660-0526 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C660-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0526?
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What is the minimum amount of C660-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0526
  • 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 C660-0526 available by request