L150-0629 Screening compound: N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide

L150-0629 Screening compound: N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide
L150-0629 Screening compound: N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L150-0629
N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)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

L150-0629

Molecular Formula

C23H19BrN4OS (C23 H19 BrN4 OS)

Compound Name

N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide

IUPAC name

N-(2-{[3-bromo-1-(2-phenylethyl)-1H-124-triazol-5-yl]sulfanyl}phenyl)benzamide

SMILES

O=C(c1ccccc1)Nc(cccc1)c1Sc1nc(Br)nn1CCc1ccccc1

InChI

InChI=1S/C23H19BrN4OS/c24-22-26-23(28(27-22)16-15-17-9-3-1-4-10-17)30-20-14-8-7-13-19(20)25-21(29)18-11-5-2-6-12-18/h1-14H,15-16H2,(H,25,29)

InChI Key

XQAIYIUDPQDTSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15119443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.306

Distribution Coefficient, logD

5.306

Water Solubility, LogSw

-5.58

Polar Surface Area

47.407

Acid Dissociation Constant (pKa)

12.71

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

L150-0629 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L150-0629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L150-0629?
Check Price and Availability of L150-0629, 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 L150-0629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L150-0629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L150-0629
  • 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 L150-0629 available by request