E201-0113 Screening compound: 1-methyl-2-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one

E201-0113 Screening compound: 1-methyl-2-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
E201-0113 Screening compound: 1-methyl-2-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E201-0113
1-methyl-2-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-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

E201-0113

Molecular Formula

C21H18N4O2 (C21 H18 N4 O2)

Compound Name

1-methyl-2-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one

IUPAC name

6-methyl-5-(2-methyl-23-dihydro-1H-indole-1-carbonyl)-168-triazatricyclo[7.4.0.0^{37}]trideca-3(7)481012-pentaen-2-one

SMILES

CC(C1)N(C(c(n2C)cc3c2N=C(C=CC=C2)N2C3=O)=O)c2c1cccc2

InChI

InChI=1S/C21H18N4O2/c1-13-11-14-7-3-4-8-16(14)25(13)21(27)17-12-15-19(23(17)2)22-18-9-5-6-10-24(18)20(15)26/h3-10,12-13H,11H2,1-2H3/t13-/m0/s1

InChI Key

JULQJLWVTJZKEC-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD05894923

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.804

Distribution Coefficient, logD

2.804

Water Solubility, LogSw

-3.43

Polar Surface Area

42.020

Acid Dissociation Constant (pKa)

26.30

Base Dissociation Constant (pKb)

0.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

E201-0113 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS targets activity set (6557 compounds)

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 E201-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E201-0113?
Check Price and Availability of E201-0113, 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 E201-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E201-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E201-0113
  • 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 E201-0113 available by request