D466-0323 Screening compound: N~1~-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)-4-fluorobenzamide

D466-0323 Screening compound: N~1~-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)-4-fluorobenzamide
D466-0323 Screening compound: N~1~-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D466-0323
N~1~-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)-4-fluorobenzamide

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

D466-0323

Molecular Formula

C21H23FN4O (C21 H23 FN4 O)

Compound Name

N~1~-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)-4-fluorobenzamide

IUPAC name

N-{11-butyl-1811-triazatricyclo[7.4.0.0^{27}]trideca-2(7)358-tetraen-5-yl}-4-fluorobenzamide

SMILES

CCCCN1Cc2nc(cc(cc3)NC(c(cc4)ccc4F)=O)c3n2CC1

InChI

InChI=1S/C21H23FN4O/c1-2-3-10-25-11-12-26-19-9-8-17(13-18(19)24-20(26)14-25)23-21(27)15-4-6-16(22)7-5-15/h4-9,13H,2-3,10-12,14H2,1H3,(H,23,27)

InChI Key

LNLVTVBTFXEWAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14830150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.890

Distribution Coefficient, logD

3.865

Water Solubility, LogSw

-3.80

Polar Surface Area

38.255

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

6.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D466-0323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D466-0323?
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What is the minimum amount of D466-0323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D466-0323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D466-0323
  • 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 D466-0323 available by request