C094-1480 Screening compound: 2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide

C094-1480 Screening compound: 2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide
C094-1480 Screening compound: 2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-1480
2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide

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

C094-1480

Molecular Formula

C27H30N2O (C27 H30 N2 O)

Compound Name

2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide

IUPAC name

2-[benzyl(phenyl)amino]-N-cyclopentyl-2-(4-methylphenyl)acetamide

SMILES

Cc1ccc(C(C(NC2CCCC2)=O)N(Cc2ccccc2)c2ccccc2)cc1

InChI

InChI=1S/C27H30N2O/c1-21-16-18-23(19-17-21)26(27(30)28-24-12-8-9-13-24)29(25-14-6-3-7-15-25)20-22-10-4-2-5-11-22/h2-7,10-11,14-19,24,26H,8-9,12-13,20H2,1H3,(H,28,30)/t26-/m1/s1

InChI Key

DWSIMMRVLUVHQP-AREMUKBSSA-N

MDL Number (MFCD)

MFCD03449879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.55

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.999

Distribution Coefficient, logD

5.999

Water Solubility, LogSw

-5.47

Polar Surface Area

26.471

Acid Dissociation Constant (pKa)

15.21

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

C094-1480 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 C094-1480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-1480?
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What is the minimum amount of C094-1480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-1480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-1480
  • 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 C094-1480 available by request