V014-9750 Screening compound: [5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrol-3-yl][4-(2-methylphenyl)piperazino]methanone

V014-9750 Screening compound: [5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrol-3-yl][4-(2-methylphenyl)piperazino]methanone
V014-9750 Screening compound: [5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrol-3-yl][4-(2-methylphenyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-9750
[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrol-3-yl][4-(2-methylphenyl)piperazino]methanone

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

V014-9750

Molecular Formula

C29H27ClFN3O (C29 H27 ClFN3 O)

Compound Name

[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrol-3-yl][4-(2-methylphenyl)piperazino]methanone

IUPAC name

1-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(2-methylphenyl)piperazine

SMILES

Cc(n(c(-c(cc1)ccc1Cl)c1)-c2cc(F)ccc2)c1C(N(CC1)CCN1c1c(C)cccc1)=O

InChI

InChI=1S/C29H27ClFN3O/c1-20-6-3-4-9-27(20)32-14-16-33(17-15-32)29(35)26-19-28(22-10-12-23(30)13-11-22)34(21(26)2)25-8-5-7-24(31)18-25/h3-13,18-19H,14-17H2,1-2H3

InChI Key

IZVUDMXJKKGESC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14246261

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

488

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.867

Distribution Coefficient, logD

6.867

Water Solubility, LogSw

-6.16

Polar Surface Area

21.269

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

References: we are preparing a list of scientific research reports with V014-9750 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-9750?
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What is the minimum amount of V014-9750 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-9750
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-9750
  • 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 V014-9750 available by request