3615-0225 Screening compound: 1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1,2,3,4-tetrazole

3615-0225 Screening compound: 1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1,2,3,4-tetrazole
3615-0225 Screening compound: 1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3615-0225
1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1,2,3,4-tetrazole

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

3615-0225

Molecular Formula

C14H10ClN5O2S (C14 H10 ClN5 O2 S)

Compound Name

1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1,2,3,4-tetrazole

IUPAC name

1-(4-chlorophenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1H-1234-tetrazole

SMILES

[O-][N+](c1ccc(CSc2nnnn2-c(cc2)ccc2Cl)cc1)=O

InChI

InChI=1S/C14H10ClN5O2S/c15-11-3-7-12(8-4-11)19-14(16-17-18-19)23-9-10-1-5-13(6-2-10)20(21)22/h1-8H,9H2

InChI Key

QYYYEBDMERBEFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02221214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.78

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.740

Distribution Coefficient, logD

3.740

Water Solubility, LogSw

-4.28

Polar Surface Area

73.270

Acid Dissociation Constant (pKa)

24.41

Base Dissociation Constant (pKb)

-2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

3615-0225 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 3615-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3615-0225?
Check Price and Availability of 3615-0225, 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 3615-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3615-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3615-0225
  • 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 3615-0225 available by request