L995-0853 Screening compound: N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-1,2-benzoxazole-5-sulfonamide

L995-0853 Screening compound: N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-1,2-benzoxazole-5-sulfonamide
L995-0853 Screening compound: N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-1,2-benzoxazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L995-0853
N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-1,2-benzoxazole-5-sulfonamide

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

L995-0853

Molecular Formula

C18H16BrN3O5S (C18 H16 BrN3 O5 S)

Compound Name

N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-1,2-benzoxazole-5-sulfonamide

IUPAC name

N-(3-bromophenyl)-3-(morpholine-4-carbonyl)-12-benzoxazole-5-sulfonamide

SMILES

O=C(c1noc(cc2)c1cc2S(Nc1cccc(Br)c1)(=O)=O)N1CCOCC1

InChI

InChI=1S/C18H16BrN3O5S/c19-12-2-1-3-13(10-12)21-28(24,25)14-4-5-16-15(11-14)17(20-27-16)18(23)22-6-8-26-9-7-22/h1-5,10-11,21H,6-9H2

InChI Key

WFRSZEUIQPJWHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27491523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.771

Distribution Coefficient, logD

2.205

Water Solubility, LogSw

-3.41

Polar Surface Area

87.644

Acid Dissociation Constant (pKa)

6.97

Base Dissociation Constant (pKb)

-2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with L995-0853 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L995-0853?
Check Price and Availability of L995-0853, 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 L995-0853 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L995-0853
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L995-0853
  • 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 L995-0853 available by request