V005-2992 Screening compound: 4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine

V005-2992 Screening compound: 4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine
V005-2992 Screening compound: 4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-2992
4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine

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

V005-2992

Molecular Formula

C30H29ClN4O (C30 H29 ClN4 O)

Compound Name

4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine

IUPAC name

4-[4-(3-chlorobenzoyl)piperazin-1-yl]-6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidine

SMILES

Cc1cccc(Cc2c(C)nc(-c3ccccc3)nc2N(CC2)CCN2C(c2cccc(Cl)c2)=O)c1

InChI

InChI=1S/C30H29ClN4O/c1-21-8-6-9-23(18-21)19-27-22(2)32-28(24-10-4-3-5-11-24)33-29(27)34-14-16-35(17-15-34)30(36)25-12-7-13-26(31)20-25/h3-13,18,20H,14-17,19H2,1-2H3

InChI Key

KKPJMCWLNPKLNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19850497

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

497.04

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.492

Distribution Coefficient, logD

7.417

Water Solubility, LogSw

-6.29

Polar Surface Area

38.685

Acid Dissociation Constant (pKa)

20.84

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.30

V005-2992 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V005-2992 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-2992?
Check Price and Availability of V005-2992, 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 V005-2992 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-2992
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-2992
  • 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 V005-2992 available by request