V018-3149 Screening compound: 1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

V018-3149 Screening compound: 1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine
V018-3149 Screening compound: 1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-3149
1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

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

V018-3149

Molecular Formula

C31H30FN3O (C31 H30 FN3 O)

Compound Name

1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

IUPAC name

1-[1-(2-fluorophenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine

SMILES

Cc(n(c(-c1ccccc1)c1)-c(cccc2)c2F)c1C(N1CCN(C/C=C/c2ccccc2)CC1)=O

InChI

InChI=1S/C31H30FN3O/c1-24-27(23-30(26-14-6-3-7-15-26)35(24)29-17-9-8-16-28(29)32)31(36)34-21-19-33(20-22-34)18-10-13-25-11-4-2-5-12-25/h2-17,23H,18-22H2,1H3

InChI Key

RDOFHKVZUXVFTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14246034

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

479.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.932

Distribution Coefficient, logD

5.930

Water Solubility, LogSw

-5.68

Polar Surface Area

21.527

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.40

V018-3149 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V018-3149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-3149?
Check Price and Availability of V018-3149, 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 V018-3149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-3149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-3149
  • 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 V018-3149 available by request