V009-1773 Screening compound: 2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydroisoquinolin-1-one

V009-1773 Screening compound: 2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydroisoquinolin-1-one
V009-1773 Screening compound: 2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydroisoquinolin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-1773
2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydroisoquinolin-1-one

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

V009-1773

Molecular Formula

C32H35N3O3 (C32 H35 N3 O3)

Compound Name

2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydroisoquinolin-1-one

IUPAC name

2-cyclopropyl-3-(3-methoxyphenyl)-4-[4-(2-phenylethyl)piperazine-1-carbonyl]-1234-tetrahydroisoquinolin-1-one

SMILES

COc1cccc(C(C(C(N2CCN(CCc3ccccc3)CC2)=O)c2c3cccc2)N(C2CC2)C3=O)c1

InChI

InChI=1S/C32H35N3O3/c1-38-26-11-7-10-24(22-26)30-29(27-12-5-6-13-28(27)31(36)35(30)25-14-15-25)32(37)34-20-18-33(19-21-34)17-16-23-8-3-2-4-9-23/h2-13,22,25,29-30H,14-21H2,1H3

InChI Key

OBQRQMDQTUNYEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19975545

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

509.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.430

Distribution Coefficient, logD

4.342

Water Solubility, LogSw

-4.43

Polar Surface Area

42.915

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

6.75

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.50

V009-1773 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with V009-1773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-1773?
Check Price and Availability of V009-1773, 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 V009-1773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-1773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-1773
  • 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 V009-1773 available by request