V030-8823 Screening compound: 6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-piperidinecarboxamide

V030-8823 Screening compound: 6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-piperidinecarboxamide
V030-8823 Screening compound: 6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8823
6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-piperidinecarboxamide

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

V030-8823

Molecular Formula

C21H30FN3O3 (C21 H30 FN3 O3)

Compound Name

6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-piperidinecarboxamide

IUPAC name

6-(4-fluorophenyl)-1-(2-methoxyacetyl)-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-3-carboxamide

SMILES

COCC(N(CC(CC1)C(NCCN2CCCC2)=O)C1c(cc1)ccc1F)=O

InChI

InChI=1S/C21H30FN3O3/c1-28-15-20(26)25-14-17(21(27)23-10-13-24-11-2-3-12-24)6-9-19(25)16-4-7-18(22)8-5-16/h4-5,7-8,17,19H,2-3,6,9-15H2,1H3,(H,23,27)

InChI Key

WTBOKMXNAADMLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19898101

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

391.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.660

Distribution Coefficient, logD

-0.581

Water Solubility, LogSw

-1.95

Polar Surface Area

53.014

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

9.64

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

V030-8823 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V030-8823 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8823?
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What is the minimum amount of V030-8823 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8823
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8823
  • 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 V030-8823 available by request