F019-1795 Screening compound: 1-(furan-2-carbonyl)-N3,N5-bis[(naphthalen-1-yl)methyl]-1H-1,2,4-triazole-3,5-diamine

F019-1795 Screening compound: 1-(furan-2-carbonyl)-N3,N5-bis[(naphthalen-1-yl)methyl]-1H-1,2,4-triazole-3,5-diamine
F019-1795 Screening compound: 1-(furan-2-carbonyl)-N3,N5-bis[(naphthalen-1-yl)methyl]-1H-1,2,4-triazole-3,5-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound F019-1795
1-(furan-2-carbonyl)-N3,N5-bis[(naphthalen-1-yl)methyl]-1H-1,2,4-triazole-3,5-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

F019-1795

Molecular Formula

C29H23N5O2 (C29 H23 N5 O2)

Compound Name

1-(furan-2-carbonyl)-N3,N5-bis[(naphthalen-1-yl)methyl]-1H-1,2,4-triazole-3,5-diamine

IUPAC name

1-(furan-2-carbonyl)-N3N5-bis[(naphthalen-1-yl)methyl]-1H-124-triazole-35-diamine

SMILES

O=C(c1ccco1)n1nc(NCc2cccc3ccccc23)nc1NCc1cccc2ccccc12

InChI

InChI=1S/C29H23N5O2/c35-27(26-16-7-17-36-26)34-29(31-19-23-13-6-11-21-9-2-4-15-25(21)23)32-28(33-34)30-18-22-12-5-10-20-8-1-3-14-24(20)22/h1-17H,18-19H2,(H2,30,31,32,33)

InChI Key

GRAHWYJMEUORHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06664110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.709

Distribution Coefficient, logD

5.709

Water Solubility, LogSw

-7.03

Polar Surface Area

68.903

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.90

F019-1795 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F019-1795 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F019-1795?
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What is the minimum amount of F019-1795 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F019-1795
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F019-1795
  • 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 F019-1795 available by request