Y043-1773 Screening compound: 2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

Y043-1773 Screening compound: 2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide
Y043-1773 Screening compound: 2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-1773
2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

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

Y043-1773

Molecular Formula

C21H20N4O2 (C21 H20 N4 O2)

Compound Name

2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

IUPAC name

2-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1-oxo-3-phenyl-1234-tetrahydroisoquinoline-4-carboxamide

SMILES

Cn1ncc(NC(C(C(c2ccccc2)N2C)c(cccc3)c3C2=O)=O)c1

InChI

InChI=1S/C21H20N4O2/c1-24-13-15(12-22-24)23-20(26)18-16-10-6-7-11-17(16)21(27)25(2)19(18)14-8-4-3-5-9-14/h3-13,18-19H,1-2H3,(H,23,26)

InChI Key

XBHOEJPBWUNQTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18799474

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.763

Distribution Coefficient, logD

1.728

Water Solubility, LogSw

-2.37

Polar Surface Area

53.589

Acid Dissociation Constant (pKa)

8.47

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

19.05

Y043-1773 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 Y043-1773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-1773?
Check Price and Availability of Y043-1773, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y043-1773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-1773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-1773
  • 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 Y043-1773 available by request