G281-1688 Screening compound: N~5~-(2-ethoxyphenyl)-4,9-dimethyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide

G281-1688 Screening compound: N~5~-(2-ethoxyphenyl)-4,9-dimethyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
G281-1688 Screening compound: N~5~-(2-ethoxyphenyl)-4,9-dimethyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G281-1688
N~5~-(2-ethoxyphenyl)-4,9-dimethyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-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

G281-1688

Molecular Formula

C24H28N4O2S (C24 H28 N4 O2 S)

Compound Name

N~5~-(2-ethoxyphenyl)-4,9-dimethyl-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide

IUPAC name

N-(2-ethoxyphenyl)-714-dimethyl-17-thia-2814-triazatetracyclo[8.7.0.0^{26}.0^{1116}]heptadeca-1(10)3511(16)-tetraene-8-carboxamide

SMILES

CCOc(cccc1)c1NC(N(C1)C(C)c2cccn2-c2c1c(CCN(C)C1)c1s2)=O

InChI

InChI=1S/C24H28N4O2S/c1-4-30-21-10-6-5-8-19(21)25-24(29)28-14-18-17-11-13-26(3)15-22(17)31-23(18)27-12-7-9-20(27)16(28)2/h5-10,12,16H,4,11,13-15H2,1-3H3,(H,25,29)/t16-/m1/s1

InChI Key

AGGKBGNOIJGEMS-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD27212591

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.601

Distribution Coefficient, logD

2.837

Water Solubility, LogSw

-4.21

Polar Surface Area

36.728

Acid Dissociation Constant (pKa)

13.12

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

G281-1688 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G281-1688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G281-1688?
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What is the minimum amount of G281-1688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G281-1688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G281-1688
  • 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 G281-1688 available by request