E677-1455 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

E677-1455 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide
E677-1455 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E677-1455
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-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

E677-1455

Molecular Formula

C22H21ClN4O3S (C22 H21 ClN4 O3 S)

Compound Name

N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

IUPAC name

N-(4-chloro-13-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)acetamide

SMILES

CN(C)CCCN(C(CN(C(c1c2cccc1)=O)C2=O)=O)c(sc1ccc2)nc1c2Cl

InChI

InChI=1S/C22H21ClN4O3S/c1-25(2)11-6-12-26(22-24-19-16(23)9-5-10-17(19)31-22)18(28)13-27-20(29)14-7-3-4-8-15(14)21(27)30/h3-5,7-10H,6,11-13H2,1-2H3

InChI Key

LPWVWSMBHBRCDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11985840

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

456.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.214

Distribution Coefficient, logD

1.008

Water Solubility, LogSw

-3.69

Polar Surface Area

59.008

Acid Dissociation Constant (pKa)

23.73

Base Dissociation Constant (pKb)

9.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with E677-1455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E677-1455?
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What is the minimum amount of E677-1455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E677-1455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E677-1455
  • 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 E677-1455 available by request