SC97-0790 Screening compound: 10-(3-fluorobenzyl)-2-(4-pyridylcarbonyl)-2,6,10-triazaspiro[4.6]undecan-7-one

SC97-0790 Screening compound: 10-(3-fluorobenzyl)-2-(4-pyridylcarbonyl)-2,6,10-triazaspiro[4.6]undecan-7-one
SC97-0790 Screening compound: 10-(3-fluorobenzyl)-2-(4-pyridylcarbonyl)-2,6,10-triazaspiro[4.6]undecan-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SC97-0790
10-(3-fluorobenzyl)-2-(4-pyridylcarbonyl)-2,6,10-triazaspiro[4.6]undecan-7-one

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

SC97-0790

Molecular Formula

C21H23FN4O2 (C21 H23 FN4 O2)

Compound Name

10-(3-fluorobenzyl)-2-(4-pyridylcarbonyl)-2,6,10-triazaspiro[4.6]undecan-7-one

IUPAC name

10-[(3-fluorophenyl)methyl]-2-(pyridine-4-carbonyl)-2610-triazaspiro[4.6]undecan-7-one

SMILES

O=C(c1ccncc1)N(CC1)CC1(CN(Cc1cccc(F)c1)CC1)NC1=O

InChI

InChI=1S/C21H23FN4O2/c22-18-3-1-2-16(12-18)13-25-10-6-19(27)24-21(14-25)7-11-26(15-21)20(28)17-4-8-23-9-5-17/h1-5,8-9,12H,6-7,10-11,13-15H2,(H,24,27)/t21-/m1/s1

InChI Key

GTVHFIWNXJQTKJ-OAQYLSRUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.866

Distribution Coefficient, logD

-0.202

Water Solubility, LogSw

-1.57

Polar Surface Area

55.881

Acid Dissociation Constant (pKa)

14.06

Base Dissociation Constant (pKb)

8.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with SC97-0790 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC97-0790?
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What is the minimum amount of SC97-0790 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC97-0790
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC97-0790
  • 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 SC97-0790 available by request