F061-1001 Screening compound: 1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide

F061-1001 Screening compound: 1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
F061-1001 Screening compound: 1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F061-1001
1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-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

F061-1001

Molecular Formula

C28H30FN3O4S (C28 H30 FN3 O4 S)

Compound Name

1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide

IUPAC name

1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)-N-(1234-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide

SMILES

Cc1noc(/C=C/c(cccc2)c2F)c1S(N(CCC1)CC1C(NC(CCC1)c2c1cccc2)=O)(=O)=O

InChI

InChI=1S/C28H30FN3O4S/c1-19-27(26(36-31-19)16-15-21-9-3-5-13-24(21)29)37(34,35)32-17-7-11-22(18-32)28(33)30-25-14-6-10-20-8-2-4-12-23(20)25/h2-5,8-9,12-13,15-16,22,25H,6-7,10-11,14,17-18H2,1H3,(H,30,33)

InChI Key

MSGRXOBWVWAENV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.228

Distribution Coefficient, logD

4.228

Water Solubility, LogSw

-4.17

Polar Surface Area

77.656

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

-2.19

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

35.70

F061-1001 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F061-1001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F061-1001?
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What is the minimum amount of F061-1001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F061-1001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F061-1001
  • 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 F061-1001 available by request