8004-4481 Screening compound: N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine

8004-4481 Screening compound: N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine
8004-4481 Screening compound: N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-4481
N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine

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

8004-4481

Molecular Formula

C28H24N8O3 (C28 H24 N8 O3)

Compound Name

N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine

IUPAC name

N2-benzyl-6-[(2Z)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazin-1-yl]-N4-(4-nitrophenyl)-135-triazine-24-diamine

SMILES

COc1c(/C=N\Nc2nc(NCc3ccccc3)nc(Nc(cc3)ccc3[N+]([O-])=O)n2)c2ccccc2cc1

InChI

InChI=1S/C28H24N8O3/c1-39-25-16-11-20-9-5-6-10-23(20)24(25)18-30-35-28-33-26(29-17-19-7-3-2-4-8-19)32-27(34-28)31-21-12-14-22(15-13-21)36(37)38/h2-16,18H,17H2,1H3,(H3,29,31,32,33,34,35)

InChI Key

XVEOJZCHSNETEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00739067

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

7.334

Distribution Coefficient, logD

7.333

Water Solubility, LogSw

-7.00

Polar Surface Area

114.532

Acid Dissociation Constant (pKa)

14.06

Base Dissociation Constant (pKb)

4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

References: we are preparing a list of scientific research reports with 8004-4481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-4481?
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What is the minimum amount of 8004-4481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-4481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-4481
  • 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 8004-4481 available by request