V020-2138 Screening compound: N-{BICYCLO[2.2.1]HEPTAN-2-YL}-2-[1-(3,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-6-METHYLPYRIDINE-3-CARBOXAMIDE

V020-2138 Screening compound: N-{BICYCLO[2.2.1]HEPTAN-2-YL}-2-[1-(3,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-6-METHYLPYRIDINE-3-CARBOXAMIDE
V020-2138 Screening compound: N-{BICYCLO[2.2.1]HEPTAN-2-YL}-2-[1-(3,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-6-METHYLPYRIDINE-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-2138
N-{BICYCLO[2.2.1]HEPTAN-2-YL}-2-[1-(3,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-6-METHYLPYRIDINE-3-CARBOXAMIDE

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

V020-2138

Molecular Formula

C26H29F2N3O2 (C26 H29 F2 N3 O2)

Compound Name

N-{BICYCLO[2.2.1]HEPTAN-2-YL}-2-[1-(3,5-DIFLUOROBENZOYL)PIPERIDIN-4-YL]-6-METHYLPYRIDINE-3-CARBOXAMIDE

IUPAC name

N-{bicyclo[2.2.1]heptan-2-yl}-2-[1-(35-difluorobenzoyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide

SMILES

Cc1ccc(C(NC2C(CC3)CC3C2)=O)c(C(CC2)CCN2C(c2cc(F)cc(F)c2)=O)n1

InChI

InChI=1S/C26H29F2N3O2/c1-15-2-5-22(25(32)30-23-11-16-3-4-18(23)10-16)24(29-15)17-6-8-31(9-7-17)26(33)19-12-20(27)14-21(28)13-19/h2,5,12-14,16-18,23H,3-4,6-11H2,1H3,(H,30,32)

InChI Key

BNJCEABJYVKWEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19928994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.485

Distribution Coefficient, logD

5.484

Water Solubility, LogSw

-5.47

Polar Surface Area

50.989

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

50.00

V020-2138 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V020-2138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-2138?
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What is the minimum amount of V020-2138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-2138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-2138
  • 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 V020-2138 available by request