V001-7715 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide

V001-7715 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide
V001-7715 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-7715
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide

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

V001-7715

Molecular Formula

C29H32ClN5O3 (C29 H32 ClN5 O3)

Compound Name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide

IUPAC name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]-2-phenylacetamide

SMILES

O=C(Cc1ccccc1)N(CC1OCCC1)CC(N(CC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl)=O

InChI

InChI=1S/C29H32ClN5O3/c30-25-11-5-4-10-24(25)26-12-13-27(32-31-26)33-14-16-34(17-15-33)29(37)21-35(20-23-9-6-18-38-23)28(36)19-22-7-2-1-3-8-22/h1-5,7-8,10-13,23H,6,9,14-21H2/t23-/m1/s1

InChI Key

RGVIFQBKUWRBEK-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19829037

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

534.06

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.342

Distribution Coefficient, logD

3.338

Water Solubility, LogSw

-3.76

Polar Surface Area

64.893

Acid Dissociation Constant (pKa)

17.63

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.90

V001-7715 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V001-7715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-7715?
Check Price and Availability of V001-7715, 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 V001-7715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-7715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-7715
  • 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 V001-7715 available by request