M281-4855 Screening compound: N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-1,2,3-benzotriazole-5-carboxamide

M281-4855 Screening compound: N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-1,2,3-benzotriazole-5-carboxamide
M281-4855 Screening compound: N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-1,2,3-benzotriazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M281-4855
N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-1,2,3-benzotriazole-5-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

M281-4855

Molecular Formula

C24H22ClN5O2 (C24 H22 ClN5 O2)

Compound Name

N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-1,2,3-benzotriazole-5-carboxamide

IUPAC name

N-[(4-chlorophenyl)methyl]-1-{2-[(4-methylphenyl)carbamoyl]ethyl}-1H-123-benzotriazole-5-carboxamide

SMILES

Cc(cc1)ccc1NC(CCn1nnc2c1ccc(C(NCc(cc1)ccc1Cl)=O)c2)=O

InChI

InChI=1S/C24H22ClN5O2/c1-16-2-9-20(10-3-16)27-23(31)12-13-30-22-11-6-18(14-21(22)28-29-30)24(32)26-15-17-4-7-19(25)8-5-17/h2-11,14H,12-13,15H2,1H3,(H,26,32)(H,27,31)

InChI Key

OJUZFTOWYDRIQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.829

Distribution Coefficient, logD

3.829

Water Solubility, LogSw

-4.44

Polar Surface Area

73.206

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

M281-4855 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with M281-4855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M281-4855?
Check Price and Availability of M281-4855, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M281-4855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M281-4855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M281-4855
  • 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 M281-4855 available by request