G217-0048 Screening compound: N-{4-[(2-ethylphenyl)carbamoyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide

G217-0048 Screening compound: N-{4-[(2-ethylphenyl)carbamoyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
G217-0048 Screening compound: N-{4-[(2-ethylphenyl)carbamoyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G217-0048
N-{4-[(2-ethylphenyl)carbamoyl]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

G217-0048

Molecular Formula

C26H27N3O2 (C26 H27 N3 O2)

Compound Name

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

IUPAC name

N-{4-[(2-ethylphenyl)carbamoyl]phenyl}-2345-tetrahydro-1H-1-benzazepine-1-carboxamide

SMILES

CCc(cccc1)c1NC(c(cc1)ccc1NC(N(CCCC1)c2c1cccc2)=O)=O

InChI

InChI=1S/C26H27N3O2/c1-2-19-9-3-5-12-23(19)28-25(30)21-14-16-22(17-15-21)27-26(31)29-18-8-7-11-20-10-4-6-13-24(20)29/h3-6,9-10,12-17H,2,7-8,11,18H2,1H3,(H,27,31)(H,28,30)

InChI Key

IZXUXYINFOENHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14987290

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.894

Distribution Coefficient, logD

5.894

Water Solubility, LogSw

-5.43

Polar Surface Area

47.096

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

G217-0048 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G217-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G217-0048?
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What is the minimum amount of G217-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G217-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G217-0048
  • 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 G217-0048 available by request