P769-0023 Screening compound: 1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-1H-1,2,3-benzotriazole-5-carboxamide

P769-0023 Screening compound: 1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-1H-1,2,3-benzotriazole-5-carboxamide
P769-0023 Screening compound: 1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-1H-1,2,3-benzotriazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P769-0023
1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-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

P769-0023

Molecular Formula

C18H21N5O (C18 H21 N5 O)

Compound Name

1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-1H-1,2,3-benzotriazole-5-carboxamide

IUPAC name

1-[2-(dimethylamino)ethyl]-N-(3-methylphenyl)-1H-123-benzotriazole-5-carboxamide

SMILES

Cc1cccc(NC(c(cc2)cc3c2n(CCN(C)C)nn3)=O)c1

InChI

InChI=1S/C18H21N5O/c1-13-5-4-6-15(11-13)19-18(24)14-7-8-17-16(12-14)20-21-23(17)10-9-22(2)3/h4-8,11-12H,9-10H2,1-3H3,(H,19,24)

InChI Key

UJXQXAYDRHWKEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.363

Distribution Coefficient, logD

1.962

Water Solubility, LogSw

-2.81

Polar Surface Area

52.871

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

7.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

P769-0023 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with P769-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P769-0023?
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What is the minimum amount of P769-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P769-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P769-0023
  • 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 P769-0023 available by request