D628-0151 Screening compound: 4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide

D628-0151 Screening compound: 4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide
D628-0151 Screening compound: 4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D628-0151
4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide

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

D628-0151

Molecular Formula

C22H22BrN3O2S (C22 H22 BrN3 O2 S)

Compound Name

4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide

IUPAC name

4-[2-(13-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(3-bromo-4-methylphenyl)-4-oxobutanamide

SMILES

Cc(ccc(NC(CCC(N(CCC1)C1c1nc(cccc2)c2s1)=O)=O)c1)c1Br

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.341

Distribution Coefficient, logD

4.341

Water Solubility, LogSw

-4.16

Polar Surface Area

49.018

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with D628-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D628-0151?
Check Price and Availability of D628-0151, 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 D628-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D628-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D628-0151
  • 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 D628-0151 available by request