V018-2501 Screening compound: N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

V018-2501 Screening compound: N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide
V018-2501 Screening compound: N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-2501
N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

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

V018-2501

Molecular Formula

C27H34FN3O2 (C27 H34 FN3 O2)

Compound Name

N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

IUPAC name

N-[(3-fluorophenyl)methyl]-N-[4-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

SMILES

O=C(Cc(cc1)ccc1N(Cc1cccc(F)c1)C(C1CCCC1)=O)NCCN1CCCC1

InChI

InChI=1S/C27H34FN3O2/c28-24-9-5-6-22(18-24)20-31(27(33)23-7-1-2-8-23)25-12-10-21(11-13-25)19-26(32)29-14-17-30-15-3-4-16-30/h5-6,9-13,18,23H,1-4,7-8,14-17,19-20H2,(H,29,32)

InChI Key

XGXCHFKKFPXZCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19910769

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

451.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.933

Distribution Coefficient, logD

1.708

Water Solubility, LogSw

-3.99

Polar Surface Area

44.538

Acid Dissociation Constant (pKa)

13.37

Base Dissociation Constant (pKb)

9.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.10

References: we are preparing a list of scientific research reports with V018-2501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-2501?
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What is the minimum amount of V018-2501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-2501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-2501
  • 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 V018-2501 available by request