D338-0199F Screening compound: 5-[6-(4-ethylphenyl)-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-1,3-dimethyl-6-(1H-pyrrol-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

D338-0199F Screening compound: 5-[6-(4-ethylphenyl)-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-1,3-dimethyl-6-(1H-pyrrol-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
D338-0199F Screening compound: 5-[6-(4-ethylphenyl)-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-1,3-dimethyl-6-(1H-pyrrol-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D338-0199F
5-[6-(4-ethylphenyl)-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-1,3-dimethyl-6-(1H-pyrrol-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

D338-0199F

Molecular Formula

C26H26N6O4 (C26 H26 N6 O4)

Compound Name

5-[6-(4-ethylphenyl)-1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-1,3-dimethyl-6-(1H-pyrrol-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

5-[6-(4-ethylphenyl)-13-dimethyl-24-dioxo-1H2H3H4H7H-pyrrolo[23-d]pyrimidin-5-yl]-13-dimethyl-6-(1H-pyrrol-1-yl)-1234-tetrahydropyrimidine-24-dione

SMILES

CCc(cc1)ccc1-c([nH]c(N(C)C(N1C)=O)c2C1=O)c2C(C(N1C)=O)=C(n2cccc2)N(C)C1=O

InChI

InChI=1S/C26H26N6O4/c1-6-15-9-11-16(12-10-15)20-17(18-21(27-20)28(2)25(35)30(4)23(18)33)19-22(32-13-7-8-14-32)29(3)26(36)31(5)24(19)34/h7-14,27H,6H2,1-5H3

InChI Key

OICLVZMUXAXHHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.997

Water Solubility, LogSw

-4.18

Polar Surface Area

78.834

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

-2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.08

D338-0199F in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D338-0199F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D338-0199F?
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What is the minimum amount of D338-0199F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D338-0199F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D338-0199F
  • 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 D338-0199F available by request