Screening compound: InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2

Screening compound: InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2
Screening compound: InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2

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

V002-3454

Molecular Formula

C27H30BrN3O3S (C27 H30 BrN3 O3 S)

Compound Name

N-benzyl-2-[1-(4-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

N-benzyl-2-[1-(4-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(thiophen-2-yl)methyl]acetamide

SMILES

O=C(CN(CCN1CCOCC1)C(c(cc1)ccc1Br)=O)N(Cc1cccs1)Cc1ccccc1

InChI

InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2

InChI Key

OAJIZAYUWCCYFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19754092

InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2
  • 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 InChI=1S/C27H30BrN3O3S/c28-24-10-8-23(9-11-24)27(33)30(13-12-29-14-16-34-17-15-29)21-26(32)31(20-25-7-4-18-35-25)19-22-5-2-1-3-6-22/h1-11,18H,12-17,19-21H2 available by request