D341-1887 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

D341-1887 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide
D341-1887 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-1887
N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

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

D341-1887

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

IUPAC name

N-[4-(13-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

SMILES

CCC(CC)C(Nc(cc1)ccc1-c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C19H20N2OS/c1-3-13(4-2)18(22)20-15-11-9-14(10-12-15)19-21-16-7-5-6-8-17(16)23-19/h5-13H,3-4H2,1-2H3,(H,20,22)

InChI Key

SYKURDNPOZMGLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06091421

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.034

Distribution Coefficient, logD

5.034

Water Solubility, LogSw

-4.63

Polar Surface Area

33.050

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D341-1887 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with D341-1887 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-1887?
Check Price and Availability of D341-1887, 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 D341-1887 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-1887
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-1887
  • 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 D341-1887 available by request