4244-0281 Screening compound: 1,3-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

4244-0281 Screening compound: 1,3-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
4244-0281 Screening compound: 1,3-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4244-0281
1,3-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

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

4244-0281

Molecular Formula

C23H21N3O4 (C23 H21 N3 O4)

Compound Name

1,3-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

IUPAC name

13-dimethyl-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-13-diazinane-246-trione

SMILES

CN(C(C(C(N1C)=O)=Cc2cn(CCOc3ccccc3)c3c2cccc3)=O)C1=O

InChI

InChI=1S/C23H21N3O4/c1-24-21(27)19(22(28)25(2)23(24)29)14-16-15-26(20-11-7-6-10-18(16)20)12-13-30-17-8-4-3-5-9-17/h3-11,14-15H,12-13H2,1-2H3

InChI Key

AUWKLNCHWTUHDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03102963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

3.429

Water Solubility, LogSw

-3.41

Polar Surface Area

54.254

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

-2.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 4244-0281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4244-0281?
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What is the minimum amount of 4244-0281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4244-0281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4244-0281
  • 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 4244-0281 available by request