3288-0250 Screening compound: (5E)-1-(3,5-dimethylphenyl)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

3288-0250 Screening compound: (5E)-1-(3,5-dimethylphenyl)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
3288-0250 Screening compound: (5E)-1-(3,5-dimethylphenyl)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3288-0250
(5E)-1-(3,5-dimethylphenyl)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-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

3288-0250

Molecular Formula

C27H27N3O3 (C27 H27 N3 O3)

Compound Name

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

IUPAC name

(5E)-1-(35-dimethylphenyl)-5-{[1-(34-dimethylphenyl)-25-dimethyl-1H-pyrrol-3-yl]methylidene}-13-diazinane-246-trione

SMILES

Cc1cc(/C=C(\C(NC(N2c3cc(C)cc(C)c3)=O)=O)/C2=O)c(C)n1-c1cc(C)c(C)cc1

InChI

InChI=1S/C27H27N3O3/c1-15-9-16(2)11-23(10-15)30-26(32)24(25(31)28-27(30)33)14-21-13-19(5)29(20(21)6)22-8-7-17(3)18(4)12-22/h7-14H,1-6H3,(H,28,31,33)

InChI Key

GBDYHGFPZJPSBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01655665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.270

Distribution Coefficient, logD

5.267

Water Solubility, LogSw

-5.19

Polar Surface Area

56.056

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 3288-0250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3288-0250?
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What is the minimum amount of 3288-0250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3288-0250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3288-0250
  • 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 3288-0250 available by request