C329-0261 Screening compound: 2-cyclopentyl-9-methyl-1-oxo-N-(3,4,5-trimethoxyphenyl)-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide

C329-0261 Screening compound: 2-cyclopentyl-9-methyl-1-oxo-N-(3,4,5-trimethoxyphenyl)-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide
C329-0261 Screening compound: 2-cyclopentyl-9-methyl-1-oxo-N-(3,4,5-trimethoxyphenyl)-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C329-0261
2-cyclopentyl-9-methyl-1-oxo-N-(3,4,5-trimethoxyphenyl)-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide

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

C329-0261

Molecular Formula

C27H29N3O5 (C27 H29 N3 O5)

Compound Name

2-cyclopentyl-9-methyl-1-oxo-N-(3,4,5-trimethoxyphenyl)-1H,2H,9H-pyrido[3,4-b]indole-4-carboxamide

IUPAC name

2-cyclopentyl-9-methyl-1-oxo-N-(345-trimethoxyphenyl)-1H2H9H-pyrido[34-b]indole-4-carboxamide

SMILES

Cn(c1c2cccc1)c1c2C(C(Nc(cc2OC)cc(OC)c2OC)=O)=CN(C2CCCC2)C1=O

InChI

InChI=1S/C27H29N3O5/c1-29-20-12-8-7-11-18(20)23-19(15-30(27(32)24(23)29)17-9-5-6-10-17)26(31)28-16-13-21(33-2)25(35-4)22(14-16)34-3/h7-8,11-15,17H,5-6,9-10H2,1-4H3,(H,28,31)

InChI Key

RGFJQKSMITWKPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14748993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.191

Distribution Coefficient, logD

3.145

Water Solubility, LogSw

-3.50

Polar Surface Area

63.946

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C329-0261 in Drug Discovery

Included in Screening Libraries

Human Kinases Annotated Library (2415 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 C329-0261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C329-0261?
Check Price and Availability of C329-0261, 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 C329-0261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C329-0261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C329-0261
  • 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 C329-0261 available by request