E776-1938 Screening compound: 4-{4-[(benzenesulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]benzamide

E776-1938 Screening compound: 4-{4-[(benzenesulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]benzamide
E776-1938 Screening compound: 4-{4-[(benzenesulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E776-1938
4-{4-[(benzenesulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]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

E776-1938

Molecular Formula

C25H30N2O4S2 (C25 H30 N2 O4 S2)

Compound Name

4-{4-[(benzenesulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]benzamide

IUPAC name

4-{4-[(benzenesulfonyl)methyl]-5-methyl-13-oxazol-2-yl}-N-[3-(butylsulfanyl)propyl]benzamide

SMILES

CCCCSCCCNC(c(cc1)ccc1-c1nc(CS(c2ccccc2)(=O)=O)c(C)o1)=O

InChI

InChI=1S/C25H30N2O4S2/c1-3-4-16-32-17-8-15-26-24(28)20-11-13-21(14-12-20)25-27-23(19(2)31-25)18-33(29,30)22-9-6-5-7-10-22/h5-7,9-14H,3-4,8,15-18H2,1-2H3,(H,26,28)

InChI Key

BUQRCHPHKOAVHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14918226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.164

Distribution Coefficient, logD

4.164

Water Solubility, LogSw

-4.03

Polar Surface Area

71.652

Acid Dissociation Constant (pKa)

14.29

Base Dissociation Constant (pKb)

-2.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with E776-1938 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E776-1938?
Check Price and Availability of E776-1938, 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 E776-1938 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E776-1938
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E776-1938
  • 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 E776-1938 available by request