E677-0405 Screening compound: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-3,4,5-trimethoxybenzamide

E677-0405 Screening compound: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-3,4,5-trimethoxybenzamide
E677-0405 Screening compound: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E677-0405
N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-3,4,5-trimethoxybenzamide

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

E677-0405

Molecular Formula

C22H26FN3O4S (C22 H26 FN3 O4 S)

Compound Name

N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-3,4,5-trimethoxybenzamide

IUPAC name

N-[3-(dimethylamino)propyl]-N-(6-fluoro-13-benzothiazol-2-yl)-345-trimethoxybenzamide

SMILES

CN(C)CCCN(C(c(cc1OC)cc(OC)c1OC)=O)c1nc(ccc(F)c2)c2s1

InChI

InChI=1S/C22H26FN3O4S/c1-25(2)9-6-10-26(22-24-16-8-7-15(23)13-19(16)31-22)21(27)14-11-17(28-3)20(30-5)18(12-14)29-4/h7-8,11-13H,6,9-10H2,1-5H3

InChI Key

XKISYFBGJRTQFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11985547

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

447.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.623

Distribution Coefficient, logD

1.475

Water Solubility, LogSw

-3.88

Polar Surface Area

52.218

Acid Dissociation Constant (pKa)

24.47

Base Dissociation Constant (pKb)

9.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

E677-0405 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with E677-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E677-0405?
Check Price and Availability of E677-0405, 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 E677-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E677-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E677-0405
  • 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 E677-0405 available by request