V015-4381 Screening compound: 1-(4-{5-[(3-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol

V015-4381 Screening compound: 1-(4-{5-[(3-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol
V015-4381 Screening compound: 1-(4-{5-[(3-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-4381
1-(4-{5-[(3-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol

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

V015-4381

Molecular Formula

C27H33FN4O2 (C27 H33 FN4 O2)

Compound Name

1-(4-{5-[(3-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol

IUPAC name

1-(4-{5-[(3-fluorophenyl)methyl]-26-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-(2-methylphenoxy)propan-2-ol

SMILES

Cc(cccc1)c1OCC(CN(CC1)CCN1c1c(Cc2cccc(F)c2)c(C)nc(C)n1)O

InChI

InChI=1S/C27H33FN4O2/c1-19-7-4-5-10-26(19)34-18-24(33)17-31-11-13-32(14-12-31)27-25(20(2)29-21(3)30-27)16-22-8-6-9-23(28)15-22/h4-10,15,24,33H,11-14,16-18H2,1-3H3/t24-/m0/s1

InChI Key

BXKYTBJWQKZVTD-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19885079

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

464.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.190

Distribution Coefficient, logD

4.947

Water Solubility, LogSw

-5.16

Polar Surface Area

49.859

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

V015-4381 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V015-4381 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-4381?
Check Price and Availability of V015-4381, 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 V015-4381 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-4381
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-4381
  • 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 V015-4381 available by request