8019-2457 Screening compound: 1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one

8019-2457 Screening compound: 1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one
8019-2457 Screening compound: 1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-2457
1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one

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

8019-2457

Molecular Formula

C28H29N3O3 (C28 H29 N3 O3)

Compound Name

1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one

IUPAC name

1-(4-methoxyphenyl)-4-{1-[3-(2-methylphenoxy)propyl]-1H-13-benzodiazol-2-yl}pyrrolidin-2-one

SMILES

Cc(cccc1)c1OCCCn1c(cccc2)c2nc1C(CC1=O)CN1c(cc1)ccc1OC

InChI

InChI=1S/C28H29N3O3/c1-20-8-3-6-11-26(20)34-17-7-16-30-25-10-5-4-9-24(25)29-28(30)21-18-27(32)31(19-21)22-12-14-23(33-2)15-13-22/h3-6,8-15,21H,7,16-19H2,1-2H3/t21-/m1/s1

InChI Key

ZECUXQOPQQPYPX-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD04154893

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.582

Distribution Coefficient, logD

5.582

Water Solubility, LogSw

-5.33

Polar Surface Area

41.672

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 8019-2457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-2457?
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What is the minimum amount of 8019-2457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-2457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-2457
  • 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 8019-2457 available by request