D662-0497 Screening compound: N-({5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1,2,3,4-tetrazol-5-amine

D662-0497 Screening compound: N-({5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1,2,3,4-tetrazol-5-amine
D662-0497 Screening compound: N-({5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1,2,3,4-tetrazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D662-0497
N-({5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1,2,3,4-tetrazol-5-amine

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

D662-0497

Molecular Formula

C17H16Cl3N5O (C17 H16 Cl3 N5 O)

Compound Name

N-({5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1,2,3,4-tetrazol-5-amine

IUPAC name

N-({5-chloro-2-[(24-dichlorophenyl)methoxy]phenyl}methyl)-2-ethyl-2H-1234-tetrazol-5-amine

SMILES

CCn1nnc(NCc(cc(cc2)Cl)c2OCc(ccc(Cl)c2)c2Cl)n1

InChI

InChI=1S/C17H16Cl3N5O/c1-2-25-23-17(22-24-25)21-9-12-7-13(18)5-6-16(12)26-10-11-3-4-14(19)8-15(11)20/h3-8H,2,9-10H2,1H3,(H,21,23)

InChI Key

HLGUYPHQBMDSIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13370332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.71

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.997

Distribution Coefficient, logD

4.997

Water Solubility, LogSw

-5.12

Polar Surface Area

57.292

Acid Dissociation Constant (pKa)

15.06

Base Dissociation Constant (pKb)

1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D662-0497 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D662-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D662-0497?
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What is the minimum amount of D662-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D662-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D662-0497
  • 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 D662-0497 available by request