V015-5537 Screening compound: (2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-1-one

V015-5537 Screening compound: (2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-1-one
V015-5537 Screening compound: (2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5537
(2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-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

V015-5537

Molecular Formula

C31H29ClN4O (C31 H29 ClN4 O)

Compound Name

(2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-1-one

IUPAC name

(2E)-1-(4-{5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl}piperazin-1-yl)-3-phenylprop-2-en-1-one

SMILES

Cc1nc(-c2ccccc2)nc(N(CC2)CCN2C(/C=C/c2ccccc2)=O)c1Cc(cc1)ccc1Cl

InChI

InChI=1S/C31H29ClN4O/c1-23-28(22-25-12-15-27(32)16-13-25)31(34-30(33-23)26-10-6-3-7-11-26)36-20-18-35(19-21-36)29(37)17-14-24-8-4-2-5-9-24/h2-17H,18-22H2,1H3

InChI Key

CHNAGJSLZDOYIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14245495

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

509.05

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.517

Distribution Coefficient, logD

7.442

Water Solubility, LogSw

-6.41

Polar Surface Area

38.158

Acid Dissociation Constant (pKa)

20.37

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.40

V015-5537 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V015-5537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5537?
Check Price and Availability of V015-5537, 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 V015-5537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5537
  • 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 V015-5537 available by request