E848-3655 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide

E848-3655 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide
E848-3655 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E848-3655
N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide

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

E848-3655

Molecular Formula

C26H33N3O4S (C26 H33 N3 O4 S)

Compound Name

N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-2-[5-(piperidine-1-sulfonyl)-1H-indol-1-yl]butanamide

SMILES

CCC(C(NCc(cc1)ccc1OCC)=O)n(cc1)c(cc2)c1cc2S(N1CCCCC1)(=O)=O

InChI

InChI=1S/C26H33N3O4S/c1-3-24(26(30)27-19-20-8-10-22(11-9-20)33-4-2)29-17-14-21-18-23(12-13-25(21)29)34(31,32)28-15-6-5-7-16-28/h8-14,17-18,24H,3-7,15-16,19H2,1-2H3,(H,27,30)/t24-/m0/s1

InChI Key

YIGASZJKWNDJPM-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14921613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.193

Distribution Coefficient, logD

4.193

Water Solubility, LogSw

-4.03

Polar Surface Area

65.593

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

E848-3655 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E848-3655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E848-3655?
Check Price and Availability of E848-3655, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E848-3655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E848-3655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E848-3655
  • 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 E848-3655 available by request