F832-0965 Screening compound: N-CYCLOPROPYL-3-[11-(4-FLUOROPHENYL)-346910-PENTAAZATRICYCLO[7.3.0.0{26}]DODECA-1(12)24710-PENTAEN-5-YL]PROPANAMIDE

F832-0965 Screening compound: N-CYCLOPROPYL-3-[11-(4-FLUOROPHENYL)-346910-PENTAAZATRICYCLO[7.3.0.0{26}]DODECA-1(12)24710-PENTAEN-5-YL]PROPANAMIDE
F832-0965 Screening compound: N-CYCLOPROPYL-3-[11-(4-FLUOROPHENYL)-346910-PENTAAZATRICYCLO[7.3.0.0{26}]DODECA-1(12)24710-PENTAEN-5-YL]PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound F832-0965
N-CYCLOPROPYL-3-[11-(4-FLUOROPHENYL)-346910-PENTAAZATRICYCLO[7.3.0.0{26}]DODECA-1(12)24710-PENTAEN-5-YL]PROPANAMIDE

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

F832-0965

Molecular Formula

C19H17FN6O (C19 H17 FN6 O)

Compound Name

N-CYCLOPROPYL-3-[11-(4-FLUOROPHENYL)-346910-PENTAAZATRICYCLO[7.3.0.0{26}]DODECA-1(12)24710-PENTAEN-5-YL]PROPANAMIDE

IUPAC name

N-cyclopropyl-3-[11-(4-fluorophenyl)-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)24710-pentaen-5-yl]propanamide

SMILES

O=C(CCc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1F)NC1CC1

InChI

InChI=1S/C19H17FN6O/c20-13-3-1-12(2-4-13)15-11-16-19-23-22-17(25(19)9-10-26(16)24-15)7-8-18(27)21-14-5-6-14/h1-4,9-11,14H,5-8H2,(H,21,27)

InChI Key

VNDSKGUUPVHMFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.270

Distribution Coefficient, logD

1.236

Water Solubility, LogSw

-1.95

Polar Surface Area

58.230

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

F832-0965 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F832-0965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F832-0965?
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What is the minimum amount of F832-0965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F832-0965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F832-0965
  • 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 F832-0965 available by request