3572-6033 Screening compound: 4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one

3572-6033 Screening compound: 4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
3572-6033 Screening compound: 4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3572-6033
4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-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

3572-6033

Molecular Formula

C22H24N2O4 (C22 H24 N2 O4)

Compound Name

4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one

IUPAC name

4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-methoxyphenyl)-25-dihydro-1H-pyrrol-2-one

SMILES

CN(C)CCN(C(C(C(c1ccccc1)=O)=C1O)c(cc2)ccc2OC)C1=O

InChI

InChI=1S/C22H24N2O4/c1-23(2)13-14-24-19(15-9-11-17(28-3)12-10-15)18(21(26)22(24)27)20(25)16-7-5-4-6-8-16/h4-12,19,26H,13-14H2,1-3H3/t19-/m0/s1

InChI Key

XDORZHMSUPGPDO-IBGZPJMESA-N

MDL Number (MFCD)

MFCD02048183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.525

Distribution Coefficient, logD

1.693

Water Solubility, LogSw

-2.53

Polar Surface Area

56.486

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

8.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

3572-6033 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3572-6033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3572-6033?
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What is the minimum amount of 3572-6033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3572-6033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3572-6033
  • 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 3572-6033 available by request