D073-0042 Screening compound: N~1~-[2-(1-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl]benzamide

D073-0042 Screening compound: N~1~-[2-(1-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl]benzamide
D073-0042 Screening compound: N~1~-[2-(1-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D073-0042
N~1~-[2-(1-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl]benzamide

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

D073-0042

Molecular Formula

C25H24N4O (C25 H24 N4 O)

Compound Name

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

IUPAC name

N-[11-(1-phenylethyl)-1811-triazatricyclo[7.4.0.0^{27}]trideca-2(7)358-tetraen-5-yl]benzamide

SMILES

CC(c1ccccc1)N1Cc2nc(cc(cc3)NC(c4ccccc4)=O)c3n2CC1

InChI

InChI=1S/C25H24N4O/c1-18(19-8-4-2-5-9-19)28-14-15-29-23-13-12-21(16-22(23)27-24(29)17-28)26-25(30)20-10-6-3-7-11-20/h2-13,16,18H,14-15,17H2,1H3,(H,26,30)/t18-/m0/s1

InChI Key

KHJFAENTGIZOAM-SFHVURJKSA-N

MDL Number (MFCD)

MFCD06000892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.465

Distribution Coefficient, logD

4.462

Water Solubility, LogSw

-4.21

Polar Surface Area

37.677

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

5.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with D073-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D073-0042?
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What is the minimum amount of D073-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D073-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D073-0042
  • 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 D073-0042 available by request