V003-5467 Screening compound: N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide

V003-5467 Screening compound: N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
V003-5467 Screening compound: N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-5467
N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide

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

V003-5467

Molecular Formula

C31H32FN5OS (C31 H32 FN5 OS)

Compound Name

N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide

IUPAC name

N-benzyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide

SMILES

Cc1nc(SCc(cc2)ccc2C(N(C)Cc2ccccc2)=O)nc(N(CC2)CCN2c(cccc2)c2F)c1

InChI

InChI=1S/C31H32FN5OS/c1-23-20-29(37-18-16-36(17-19-37)28-11-7-6-10-27(28)32)34-31(33-23)39-22-25-12-14-26(15-13-25)30(38)35(2)21-24-8-4-3-5-9-24/h3-15,20H,16-19,21-22H2,1-2H3

InChI Key

SVPKGDIZRLTMQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826889

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

541.69

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.072

Distribution Coefficient, logD

6.072

Water Solubility, LogSw

-5.52

Polar Surface Area

39.092

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.80

References: we are preparing a list of scientific research reports with V003-5467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-5467?
Check Price and Availability of V003-5467, 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 V003-5467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-5467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-5467
  • 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 V003-5467 available by request