Y032-4240 Screening compound: 1-(2,4-dimethoxyphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

Y032-4240 Screening compound: 1-(2,4-dimethoxyphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide
Y032-4240 Screening compound: 1-(2,4-dimethoxyphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-4240
1-(2,4-dimethoxyphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

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

Y032-4240

Molecular Formula

C21H21N3O4S (C21 H21 N3 O4 S)

Compound Name

1-(2,4-dimethoxyphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

IUPAC name

1-(24-dimethoxyphenyl)-N-(4-methyl-13-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxamide

SMILES

Cc1cccc2c1nc(NC(C(CC1=O)CN1c(ccc(OC)c1)c1OC)=O)s2

InChI

InChI=1S/C21H21N3O4S/c1-12-5-4-6-17-19(12)22-21(29-17)23-20(26)13-9-18(25)24(11-13)15-8-7-14(27-2)10-16(15)28-3/h4-8,10,13H,9,11H2,1-3H3,(H,22,23,26)/t13-/m0/s1

InChI Key

BQCQJKWHEOKQNS-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD09270346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.583

Distribution Coefficient, logD

3.581

Water Solubility, LogSw

-3.92

Polar Surface Area

65.485

Acid Dissociation Constant (pKa)

9.63

Base Dissociation Constant (pKb)

0.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.57

References: we are preparing a list of scientific research reports with Y032-4240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-4240?
Check Price and Availability of Y032-4240, 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 Y032-4240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-4240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-4240
  • 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 Y032-4240 available by request