M183-0850 Screening compound: 2-[4-(azepan-1-yl)-1-oxo-1,2-dihydrophthalazin-2-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide

M183-0850 Screening compound: 2-[4-(azepan-1-yl)-1-oxo-1,2-dihydrophthalazin-2-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide
M183-0850 Screening compound: 2-[4-(azepan-1-yl)-1-oxo-1,2-dihydrophthalazin-2-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M183-0850
2-[4-(azepan-1-yl)-1-oxo-1,2-dihydrophthalazin-2-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide

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

M183-0850

Molecular Formula

C25H28N4O2 (C25 H28 N4 O2)

Compound Name

2-[4-(azepan-1-yl)-1-oxo-1,2-dihydrophthalazin-2-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide

IUPAC name

2-[4-(azepan-1-yl)-1-oxo-12-dihydrophthalazin-2-yl]-N-(23-dihydro-1H-inden-1-yl)acetamide

SMILES

O=C(CN(C(c1c2cccc1)=O)N=C2N1CCCCCC1)NC(CC1)c2c1cccc2

InChI

InChI=1S/C25H28N4O2/c30-23(26-22-14-13-18-9-3-4-10-19(18)22)17-29-25(31)21-12-6-5-11-20(21)24(27-29)28-15-7-1-2-8-16-28/h3-6,9-12,22H,1-2,7-8,13-17H2,(H,26,30)/t22-/m0/s1

InChI Key

OUJRYRVBJDLBDJ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD27533885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.787

Distribution Coefficient, logD

3.787

Water Solubility, LogSw

-3.91

Polar Surface Area

55.249

Acid Dissociation Constant (pKa)

13.14

Base Dissociation Constant (pKb)

9.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

M183-0850 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with M183-0850 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M183-0850?
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What is the minimum amount of M183-0850 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M183-0850
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M183-0850
  • 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 M183-0850 available by request