3553-1974 Screening compound: 3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]naphthalene-2-carboxamide

3553-1974 Screening compound: 3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]naphthalene-2-carboxamide
3553-1974 Screening compound: 3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]naphthalene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3553-1974
3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]naphthalene-2-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

3553-1974

Molecular Formula

C26H22N4O3 (C26 H22 N4 O3)

Compound Name

3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]naphthalene-2-carboxamide

IUPAC name

3-methoxy-N-[2-(4-methoxyphenyl)-6-methyl-2H-123-benzotriazol-5-yl]naphthalene-2-carboxamide

SMILES

Cc1cc2nn(-c(cc3)ccc3OC)nc2cc1NC(c1cc2ccccc2cc1OC)=O

InChI

InChI=1S/C26H22N4O3/c1-16-12-23-24(29-30(28-23)19-8-10-20(32-2)11-9-19)15-22(16)27-26(31)21-13-17-6-4-5-7-18(17)14-25(21)33-3/h4-15H,1-3H3,(H,27,31)

InChI Key

LQABZVDVRZWTED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02219275

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.661

Distribution Coefficient, logD

5.396

Water Solubility, LogSw

-6.46

Polar Surface Area

61.569

Acid Dissociation Constant (pKa)

7.48

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

References: we are preparing a list of scientific research reports with 3553-1974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3553-1974?
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What is the minimum amount of 3553-1974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3553-1974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3553-1974
  • 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 3553-1974 available by request