E676-1446 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-3,4-dimethylbenzamide

E676-1446 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-3,4-dimethylbenzamide
E676-1446 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-3,4-dimethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E676-1446
N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-3,4-dimethylbenzamide

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

E676-1446

Molecular Formula

C20H22ClN3OS (C20 H22 ClN3 OS)

Compound Name

N-(4-chloro-1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-3,4-dimethylbenzamide

IUPAC name

N-(4-chloro-13-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-34-dimethylbenzamide

SMILES

Cc(cc1)c(C)cc1C(N(CCN(C)C)c(sc1ccc2)nc1c2Cl)=O

InChI

InChI=1S/C20H22ClN3OS/c1-13-8-9-15(12-14(13)2)19(25)24(11-10-23(3)4)20-22-18-16(21)6-5-7-17(18)26-20/h5-9,12H,10-11H2,1-4H3

InChI Key

HCYVJWUPYDQHEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11984921

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

387.93

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.142

Distribution Coefficient, logD

4.897

Water Solubility, LogSw

-5.66

Polar Surface Area

30.011

Acid Dissociation Constant (pKa)

22.54

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

E676-1446 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with E676-1446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E676-1446?
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What is the minimum amount of E676-1446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E676-1446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E676-1446
  • 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 E676-1446 available by request