M415-0057 Screening compound: 3,5-dimethyl-N-[(1-methyl-1H-1,2,3-benzotriazol-5-yl)methyl]benzamide

M415-0057 Screening compound: 3,5-dimethyl-N-[(1-methyl-1H-1,2,3-benzotriazol-5-yl)methyl]benzamide
M415-0057 Screening compound: 3,5-dimethyl-N-[(1-methyl-1H-1,2,3-benzotriazol-5-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M415-0057
3,5-dimethyl-N-[(1-methyl-1H-1,2,3-benzotriazol-5-yl)methyl]benzamide

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

M415-0057

Molecular Formula

C17H18N4O (C17 H18 N4 O)

Compound Name

3,5-dimethyl-N-[(1-methyl-1H-1,2,3-benzotriazol-5-yl)methyl]benzamide

IUPAC name

35-dimethyl-N-[(1-methyl-1H-123-benzotriazol-5-yl)methyl]benzamide

SMILES

Cc1cc(C(NCc(cc2)cc3c2n(C)nn3)=O)cc(C)c1

InChI

InChI=1S/C17H18N4O/c1-11-6-12(2)8-14(7-11)17(22)18-10-13-4-5-16-15(9-13)19-20-21(16)3/h4-9H,10H2,1-3H3,(H,18,22)

InChI Key

WHGBXWOHIHMXLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27540496

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.420

Distribution Coefficient, logD

2.420

Water Solubility, LogSw

-2.78

Polar Surface Area

50.635

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

M415-0057 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with M415-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M415-0057?
Check Price and Availability of M415-0057, 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 M415-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M415-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M415-0057
  • 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 M415-0057 available by request