3617-1520 Screening compound: N-[2-(4-chlorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]hexanamide

3617-1520 Screening compound: N-[2-(4-chlorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]hexanamide
3617-1520 Screening compound: N-[2-(4-chlorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3617-1520
N-[2-(4-chlorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]hexanamide

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

3617-1520

Molecular Formula

C19H21ClN4O (C19 H21 ClN4 O)

Compound Name

N-[2-(4-chlorophenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]hexanamide

IUPAC name

N-[2-(4-chlorophenyl)-6-methyl-2H-123-benzotriazol-5-yl]hexanamide

SMILES

CCCCCC(Nc1cc2nn(-c(cc3)ccc3Cl)nc2cc1C)=O

InChI

InChI=1S/C19H21ClN4O/c1-3-4-5-6-19(25)21-16-12-18-17(11-13(16)2)22-24(23-18)15-9-7-14(20)8-10-15/h7-12H,3-6H2,1-2H3,(H,21,25)

InChI Key

BIUHQYHDIDGROJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02623937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.817

Distribution Coefficient, logD

4.816

Water Solubility, LogSw

-4.67

Polar Surface Area

46.724

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with 3617-1520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3617-1520?
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What is the minimum amount of 3617-1520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3617-1520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3617-1520
  • 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 3617-1520 available by request