Y043-6379 Screening compound: N-(4-methoxyphenethyl)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)tetrahydro-1(2H)-pyridinecarboxamide

Y043-6379 Screening compound: N-(4-methoxyphenethyl)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)tetrahydro-1(2H)-pyridinecarboxamide
Y043-6379 Screening compound: N-(4-methoxyphenethyl)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)tetrahydro-1(2H)-pyridinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-6379
N-(4-methoxyphenethyl)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)tetrahydro-1(2H)-pyridinecarboxamide

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

Y043-6379

Molecular Formula

C23H28N4O2 (C23 H28 N4 O2)

Compound Name

N-(4-methoxyphenethyl)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)tetrahydro-1(2H)-pyridinecarboxamide

IUPAC name

N-[2-(4-methoxyphenyl)ethyl]-2-(1-methyl-1H-13-benzodiazol-2-yl)piperidine-1-carboxamide

SMILES

Cn1c(cccc2)c2nc1C(CCCC1)N1C(NCCc(cc1)ccc1OC)=O

InChI

InChI=1S/C23H28N4O2/c1-26-20-8-4-3-7-19(20)25-22(26)21-9-5-6-16-27(21)23(28)24-15-14-17-10-12-18(29-2)13-11-17/h3-4,7-8,10-13,21H,5-6,9,14-16H2,1-2H3,(H,24,28)/t21-/m0/s1

InChI Key

VJAQMQZDDJIDGL-NRFANRHFSA-N

MDL Number (MFCD)

MFCD30345905

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.887

Distribution Coefficient, logD

3.882

Water Solubility, LogSw

-3.97

Polar Surface Area

44.848

Acid Dissociation Constant (pKa)

16.27

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.13

Y043-6379 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y043-6379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-6379?
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What is the minimum amount of Y043-6379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-6379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-6379
  • 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 Y043-6379 available by request