G217-1017 Screening compound: N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide

G217-1017 Screening compound: N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
G217-1017 Screening compound: N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G217-1017
N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-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

G217-1017

Molecular Formula

C26H27N3O3 (C26 H27 N3 O3)

Compound Name

N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide

IUPAC name

N-(4-{[(4-methoxyphenyl)carbamoyl]methyl}phenyl)-2345-tetrahydro-1H-1-benzazepine-1-carboxamide

SMILES

COc(cc1)ccc1NC(Cc(cc1)ccc1NC(N(CCCC1)c2c1cccc2)=O)=O

InChI

InChI=1S/C26H27N3O3/c1-32-23-15-13-21(14-16-23)27-25(30)18-19-9-11-22(12-10-19)28-26(31)29-17-5-4-7-20-6-2-3-8-24(20)29/h2-3,6,8-16H,4-5,7,17-18H2,1H3,(H,27,30)(H,28,31)

InChI Key

MZBSHLIBCJLVKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14987423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.068

Distribution Coefficient, logD

5.068

Water Solubility, LogSw

-4.53

Polar Surface Area

55.125

Acid Dissociation Constant (pKa)

11.77

Base Dissociation Constant (pKb)

-0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

G217-1017 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 G217-1017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G217-1017?
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What is the minimum amount of G217-1017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G217-1017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G217-1017
  • 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 G217-1017 available by request