E677-1130 Screening compound: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide

E677-1130 Screening compound: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide
E677-1130 Screening compound: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E677-1130
N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide

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

E677-1130

Molecular Formula

C26H27N3O3S (C26 H27 N3 O3 S)

Compound Name

N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide

IUPAC name

N-[3-(dimethylamino)propyl]-N-(4-methoxy-13-benzothiazol-2-yl)-2-phenoxybenzamide

SMILES

CN(C)CCCN(C(c(cccc1)c1Oc1ccccc1)=O)c1nc(c(OC)ccc2)c2s1

InChI

InChI=1S/C26H27N3O3S/c1-28(2)17-10-18-29(26-27-24-22(31-3)15-9-16-23(24)33-26)25(30)20-13-7-8-14-21(20)32-19-11-5-4-6-12-19/h4-9,11-16H,10,17-18H2,1-3H3

InChI Key

RLFHCDGIXLWEOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11985744

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

461.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.321

Distribution Coefficient, logD

3.173

Water Solubility, LogSw

-5.22

Polar Surface Area

44.476

Acid Dissociation Constant (pKa)

24.47

Base Dissociation Constant (pKb)

9.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

E677-1130 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E677-1130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E677-1130?
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What is the minimum amount of E677-1130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E677-1130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E677-1130
  • 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 E677-1130 available by request