V019-1876 Screening compound: N-(4-methoxy-2-methylphenyl)-4-oxo-1H,2H,3H,4H,6H,7H,11bH-pyrazino[2,1-a]isoquinoline-2-carbothioamide

V019-1876 Screening compound: N-(4-methoxy-2-methylphenyl)-4-oxo-1H,2H,3H,4H,6H,7H,11bH-pyrazino[2,1-a]isoquinoline-2-carbothioamide
V019-1876 Screening compound: N-(4-methoxy-2-methylphenyl)-4-oxo-1H,2H,3H,4H,6H,7H,11bH-pyrazino[2,1-a]isoquinoline-2-carbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-1876
N-(4-methoxy-2-methylphenyl)-4-oxo-1H,2H,3H,4H,6H,7H,11bH-pyrazino[2,1-a]isoquinoline-2-carbothioamide

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

V019-1876

Molecular Formula

C21H23N3O2S (C21 H23 N3 O2 S)

Compound Name

N-(4-methoxy-2-methylphenyl)-4-oxo-1H,2H,3H,4H,6H,7H,11bH-pyrazino[2,1-a]isoquinoline-2-carbothioamide

IUPAC name

N-(4-methoxy-2-methylphenyl)-4-oxo-1H2H3H4H6H7H11bH-pyrazino[21-a]isoquinoline-2-carbothioamide

SMILES

Cc(cc(cc1)OC)c1NC(N(CC1N2CCc3c1cccc3)CC2=O)=S

InChI

InChI=1S/C21H23N3O2S/c1-14-11-16(26-2)7-8-18(14)22-21(27)23-12-19-17-6-4-3-5-15(17)9-10-24(19)20(25)13-23/h3-8,11,19H,9-10,12-13H2,1-2H3,(H,22,27)/t19-/m1/s1

InChI Key

GTYLMYLPWIDNFC-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19945694

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.716

Distribution Coefficient, logD

3.716

Water Solubility, LogSw

-4.00

Polar Surface Area

34.091

Acid Dissociation Constant (pKa)

14.05

Base Dissociation Constant (pKb)

-1.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V019-1876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-1876?
Check Price and Availability of V019-1876, 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 V019-1876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-1876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-1876
  • 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 V019-1876 available by request