V021-5537 Screening compound: {4-[4-(2-chlorophenyl)piperazino]-1-phthalazinyl}[4-(2-methoxyethyl)piperazino]methanone

V021-5537 Screening compound: {4-[4-(2-chlorophenyl)piperazino]-1-phthalazinyl}[4-(2-methoxyethyl)piperazino]methanone
V021-5537 Screening compound: {4-[4-(2-chlorophenyl)piperazino]-1-phthalazinyl}[4-(2-methoxyethyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-5537
{4-[4-(2-chlorophenyl)piperazino]-1-phthalazinyl}[4-(2-methoxyethyl)piperazino]methanone

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

V021-5537

Molecular Formula

C26H31ClN6O2 (C26 H31 ClN6 O2)

Compound Name

{4-[4-(2-chlorophenyl)piperazino]-1-phthalazinyl}[4-(2-methoxyethyl)piperazino]methanone

IUPAC name

1-[4-(2-chlorophenyl)piperazin-1-yl]-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]phthalazine

SMILES

COCCN(CC1)CCN1C(c(c1ccccc11)nnc1N(CC1)CCN1c(cccc1)c1Cl)=O

InChI

InChI=1S/C26H31ClN6O2/c1-35-19-18-30-10-12-33(13-11-30)26(34)24-20-6-2-3-7-21(20)25(29-28-24)32-16-14-31(15-17-32)23-9-5-4-8-22(23)27/h2-9H,10-19H2,1H3

InChI Key

HHCFMZRLTCDHIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14285347

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

495.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.367

Distribution Coefficient, logD

3.344

Water Solubility, LogSw

-3.39

Polar Surface Area

57.606

Acid Dissociation Constant (pKa)

23.65

Base Dissociation Constant (pKb)

6.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.31

V021-5537 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V021-5537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-5537?
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What is the minimum amount of V021-5537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-5537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-5537
  • 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 V021-5537 available by request