C200-3312 Screening compound: N-(2,5-dimethoxyphenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-1-yl]acetamide

C200-3312 Screening compound: N-(2,5-dimethoxyphenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-1-yl]acetamide
C200-3312 Screening compound: N-(2,5-dimethoxyphenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-3312
N-(2,5-dimethoxyphenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-1-yl]acetamide

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

C200-3312

Molecular Formula

C29H28N4O5 (C29 H28 N4 O5)

Compound Name

N-(2,5-dimethoxyphenyl)-2-[5,8-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-1-yl]acetamide

IUPAC name

N-(25-dimethoxyphenyl)-2-[58-dimethyl-3-(3-methylphenyl)-24-dioxo-1H2H3H4H5H-pyrimido[54-b]indol-1-yl]acetamide

SMILES

Cc(cc1)cc2c1n(C)c(C(N1c3cc(C)ccc3)=O)c2N(CC(Nc(cc(cc2)OC)c2OC)=O)C1=O

InChI

InChI=1S/C29H28N4O5/c1-17-7-6-8-19(13-17)33-28(35)27-26(21-14-18(2)9-11-23(21)31(27)3)32(29(33)36)16-25(34)30-22-15-20(37-4)10-12-24(22)38-5/h6-15H,16H2,1-5H3,(H,30,34)

InChI Key

VJPCXNWXSXFCGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.380

Distribution Coefficient, logD

4.380

Water Solubility, LogSw

-4.43

Polar Surface Area

71.361

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

C200-3312 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer

References: we are preparing a list of scientific research reports with C200-3312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-3312?
Check Price and Availability of C200-3312, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C200-3312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-3312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-3312
  • 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 C200-3312 available by request