D633-0087 Screening compound: N-[(2-methoxyphenyl)methyl]-4-(1H-1,2,3,4-tetrazol-1-yl)benzamide

D633-0087 Screening compound: N-[(2-methoxyphenyl)methyl]-4-(1H-1,2,3,4-tetrazol-1-yl)benzamide
D633-0087 Screening compound: N-[(2-methoxyphenyl)methyl]-4-(1H-1,2,3,4-tetrazol-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D633-0087
N-[(2-methoxyphenyl)methyl]-4-(1H-1,2,3,4-tetrazol-1-yl)benzamide

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

D633-0087

Molecular Formula

C16H15N5O2 (C16 H15 N5 O2)

Compound Name

N-[(2-methoxyphenyl)methyl]-4-(1H-1,2,3,4-tetrazol-1-yl)benzamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-4-(1H-1234-tetrazol-1-yl)benzamide

SMILES

COc1c(CNC(c(cc2)ccc2-n2nnnc2)=O)cccc1

InChI

InChI=1S/C16H15N5O2/c1-23-15-5-3-2-4-13(15)10-17-16(22)12-6-8-14(9-7-12)21-11-18-19-20-21/h2-9,11H,10H2,1H3,(H,17,22)

InChI Key

XDZWZFXBCHTAPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04478057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.33

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

2.166

Distribution Coefficient, logD

2.166

Water Solubility, LogSw

-2.65

Polar Surface Area

72.048

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D633-0087 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D633-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D633-0087?
Check Price and Availability of D633-0087, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D633-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D633-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D633-0087
  • 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 D633-0087 available by request