C795-1654 Screening compound: N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}acetamide

C795-1654 Screening compound: N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}acetamide
C795-1654 Screening compound: N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-1654
N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}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

C795-1654

Molecular Formula

C23H27N3O3S (C23 H27 N3 O3 S)

Compound Name

N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}acetamide

IUPAC name

N-benzyl-2-{5-[(4-methylpiperidin-1-yl)sulfonyl]-1H-indol-1-yl}acetamide

SMILES

CC(CC1)CCN1S(c(cc1)cc2c1n(CC(NCc1ccccc1)=O)cc2)(=O)=O

InChI

InChI=1S/C23H27N3O3S/c1-18-9-13-26(14-10-18)30(28,29)21-7-8-22-20(15-21)11-12-25(22)17-23(27)24-16-19-5-3-2-4-6-19/h2-8,11-12,15,18H,9-10,13-14,16-17H2,1H3,(H,24,27)

InChI Key

QWBZGFOIPOTDFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.686

Distribution Coefficient, logD

3.686

Water Solubility, LogSw

-3.83

Polar Surface Area

58.260

Acid Dissociation Constant (pKa)

12.77

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

C795-1654 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C795-1654 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-1654?
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What is the minimum amount of C795-1654 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-1654
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-1654
  • 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 C795-1654 available by request