K906-2030 Screening compound: N-(4-bromophenyl)-2-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide

K906-2030 Screening compound: N-(4-bromophenyl)-2-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide
K906-2030 Screening compound: N-(4-bromophenyl)-2-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-2030
N-(4-bromophenyl)-2-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide

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

K906-2030

Molecular Formula

C19H20BrN3O5S2 (C19 H20 BrN3 O5 S2)

Compound Name

N-(4-bromophenyl)-2-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide

IUPAC name

N-(4-bromophenyl)-2-(3-methyl-2-oxo-23-dihydro-13-benzoxazole-6-sulfonamido)-4-(methylsulfanyl)butanamide

SMILES

CN(c(ccc(S(NC(CCSC)C(Nc(cc1)ccc1Br)=O)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C19H20BrN3O5S2/c1-23-16-8-7-14(11-17(16)28-19(23)25)30(26,27)22-15(9-10-29-2)18(24)21-13-5-3-12(20)4-6-13/h3-8,11,15,22H,9-10H2,1-2H3,(H,21,24)/t15-/m0/s1

InChI Key

MHDDUYUIFWFYLU-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD15112669

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.42

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.481

Distribution Coefficient, logD

3.479

Water Solubility, LogSw

-4.14

Polar Surface Area

88.069

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-0.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with K906-2030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-2030?
Check Price and Availability of K906-2030, 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 K906-2030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-2030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-2030
  • 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 K906-2030 available by request