G281-1669 Screening compound: N~5~-(2,3-dimethylphenyl)-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

G281-1669 Screening compound: N~5~-(2,3-dimethylphenyl)-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
G281-1669 Screening compound: N~5~-(2,3-dimethylphenyl)-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 G281-1669
N~5~-(2,3-dimethylphenyl)-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

G281-1669

Molecular Formula

C24H28N4OS (C24 H28 N4 OS)

Compound Name

N~5~-(2,3-dimethylphenyl)-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-(23-dimethylphenyl)-714-dimethyl-17-thia-2814-triazatetracyclo[8.7.0.0^{26}.0^{1116}]heptadeca-1(10)3511(16)-tetraene-8-carboxamide

SMILES

CC(c1cccn1-c1c(C2)c(CCN(C)C3)c3s1)N2C(Nc1c(C)c(C)ccc1)=O

InChI

InChI=1S/C24H28N4OS/c1-15-7-5-8-20(16(15)2)25-24(29)28-13-19-18-10-12-26(4)14-22(18)30-23(19)27-11-6-9-21(27)17(28)3/h5-9,11,17H,10,12-14H2,1-4H3,(H,25,29)/t17-/m1/s1

InChI Key

UZRGZHJDTMKHGZ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27212580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.58

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.056

Distribution Coefficient, logD

3.293

Water Solubility, LogSw

-4.42

Polar Surface Area

29.518

Acid Dissociation Constant (pKa)

14.48

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

G281-1669 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 G281-1669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G281-1669?
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What is the minimum amount of G281-1669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G281-1669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G281-1669
  • 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 G281-1669 available by request