C798-0453 Screening compound: N-(2,2-diethoxyethyl)-4-(2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamide

C798-0453 Screening compound: N-(2,2-diethoxyethyl)-4-(2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamide
C798-0453 Screening compound: N-(2,2-diethoxyethyl)-4-(2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C798-0453
N-(2,2-diethoxyethyl)-4-(2-methyl-4,5,6,7-tetrahydro-1H-indol-1-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

C798-0453

Molecular Formula

C22H30N2O3 (C22 H30 N2 O3)

Compound Name

N-(2,2-diethoxyethyl)-4-(2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamide

IUPAC name

N-(22-diethoxyethyl)-4-(2-methyl-4567-tetrahydro-1H-indol-1-yl)benzamide

SMILES

CCOC(CNC(c(cc1)ccc1-n1c(CCCC2)c2cc1C)=O)OCC

InChI

InChI=1S/C22H30N2O3/c1-4-26-21(27-5-2)15-23-22(25)17-10-12-19(13-11-17)24-16(3)14-18-8-6-7-9-20(18)24/h10-14,21H,4-9,15H2,1-3H3,(H,23,25)

InChI Key

ZPPVCNJYRLIMOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14799028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.130

Distribution Coefficient, logD

3.130

Water Solubility, LogSw

-3.22

Polar Surface Area

42.147

Acid Dissociation Constant (pKa)

12.29

Base Dissociation Constant (pKb)

-3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with C798-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C798-0453?
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What is the minimum amount of C798-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C798-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C798-0453
  • 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 C798-0453 available by request