G281-2546 Screening compound: N~5~-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-9-methyl-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

G281-2546 Screening compound: N~5~-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-9-methyl-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
G281-2546 Screening compound: N~5~-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-9-methyl-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 G281-2546
N~5~-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-9-methyl-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

G281-2546

Molecular Formula

C30H32N4O2S (C30 H32 N4 O2 S)

Compound Name

N~5~-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-9-methyl-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)-7-(3-methoxyphenyl)-14-methyl-17-thia-2814-triazatetracyclo[8.7.0.0^{26}.0^{1116}]heptadeca-1(10)3511(16)-tetraene-8-carboxamide

SMILES

Cc1cccc(NC(N(Cc2c(-n3c4ccc3)sc3c2CCN(C)C3)C4c2cc(OC)ccc2)=O)c1C

InChI

InChI=1S/C30H32N4O2S/c1-19-8-5-11-25(20(19)2)31-30(35)34-17-24-23-13-15-32(3)18-27(23)37-29(24)33-14-7-12-26(33)28(34)21-9-6-10-22(16-21)36-4/h5-12,14,16,28H,13,15,17-18H2,1-4H3,(H,31,35)/t28-/m0/s1

InChI Key

IXJHWJATCJOSTL-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD27212699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.68

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

6.560

Distribution Coefficient, logD

4.796

Water Solubility, LogSw

-5.67

Polar Surface Area

37.199

Acid Dissociation Constant (pKa)

14.72

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

G281-2546 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 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 G281-2546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G281-2546?
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What is the minimum amount of G281-2546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G281-2546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G281-2546
  • 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 G281-2546 available by request