E864-0282 Screening compound: 1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-carboxamide

E864-0282 Screening compound: 1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-carboxamide
E864-0282 Screening compound: 1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E864-0282
1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-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

E864-0282

Molecular Formula

C26H25N3O2 (C26 H25 N3 O2)

Compound Name

1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-2-carboxamide

IUPAC name

1-(4-methoxyphenyl)-N-(4-methylphenyl)-1H2H3H4H9H-pyrido[34-b]indole-2-carboxamide

SMILES

Cc(cc1)ccc1NC(N(CCc1c2[nH]c3c1cccc3)C2c(cc1)ccc1OC)=O

InChI

InChI=1S/C26H25N3O2/c1-17-7-11-19(12-8-17)27-26(30)29-16-15-22-21-5-3-4-6-23(21)28-24(22)25(29)18-9-13-20(31-2)14-10-18/h3-14,25,28H,15-16H2,1-2H3,(H,27,30)/t25-/m1/s1

InChI Key

DXAMRDOHRBLNGI-RUZDIDTESA-N

MDL Number (MFCD)

MFCD01517776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.646

Distribution Coefficient, logD

5.646

Water Solubility, LogSw

-5.75

Polar Surface Area

42.436

Acid Dissociation Constant (pKa)

14.21

Base Dissociation Constant (pKb)

-0.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

E864-0282 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with E864-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E864-0282?
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What is the minimum amount of E864-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E864-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E864-0282
  • 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 E864-0282 available by request