C094-0105 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]acetamide

C094-0105 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]acetamide
C094-0105 Screening compound: 2-(2,3-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-0105
2-(2,3-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]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

C094-0105

Molecular Formula

C25H26N2O (C25 H26 N2 O)

Compound Name

2-(2,3-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]acetamide

IUPAC name

2-(23-dihydro-1H-indol-1-yl)-2-phenyl-N-[4-(propan-2-yl)phenyl]acetamide

SMILES

CC(C)c(cc1)ccc1NC(C(c1ccccc1)N(CC1)c2c1cccc2)=O

InChI

InChI=1S/C25H26N2O/c1-18(2)19-12-14-22(15-13-19)26-25(28)24(21-9-4-3-5-10-21)27-17-16-20-8-6-7-11-23(20)27/h3-15,18,24H,16-17H2,1-2H3,(H,26,28)/t24-/m1/s1

InChI Key

PTMMVDCKMHYHDW-XMMPIXPASA-N

MDL Number (MFCD)

MFCD03449668

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.49

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.180

Distribution Coefficient, logD

6.180

Water Solubility, LogSw

-5.57

Polar Surface Area

25.385

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

C094-0105 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 C094-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-0105?
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What is the minimum amount of C094-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-0105
  • 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 C094-0105 available by request