8012-4870 Screening compound: 4-azido-2-(benzylsulfonyl)benzamide

8012-4870 Screening compound: 4-azido-2-(benzylsulfonyl)benzamide
8012-4870 Screening compound: 4-azido-2-(benzylsulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-4870
4-azido-2-(benzylsulfonyl)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

8012-4870

Molecular Formula

C14H12N4O3S (C14 H12 N4 O3 S)

Compound Name

4-azido-2-(benzylsulfonyl)benzamide

IUPAC name

4-azido-2-phenylmethanesulfonylbenzamide

SMILES

NC(c(ccc(N=[N+]=[N-])c1)c1S(Cc1ccccc1)(=O)=O)=O

InChI

InChI=1S/C14H12N4O3S/c15-14(19)12-7-6-11(17-18-16)8-13(12)22(20,21)9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,15,19)

InChI Key

DHVFOQZNHXEHSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03036179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.415

Distribution Coefficient, logD

1.415

Water Solubility, LogSw

-2.43

Polar Surface Area

104.252

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

8012-4870 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8012-4870 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-4870?
Check Price and Availability of 8012-4870, 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 8012-4870 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-4870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-4870
  • 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 8012-4870 available by request