3341-1856 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzamide

3341-1856 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzamide
3341-1856 Screening compound: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3341-1856
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]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

3341-1856

Molecular Formula

C26H25N3O5S (C26 H25 N3 O5 S)

Compound Name

N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzamide

IUPAC name

N-[4-(13-benzoxazol-2-yl)phenyl]-4-[(26-dimethylmorpholin-4-yl)sulfonyl]benzamide

SMILES

CC(C1)OC(C)CN1S(c(cc1)ccc1C(Nc(cc1)ccc1-c1nc(cccc2)c2o1)=O)(=O)=O

InChI

InChI=1S/C26H25N3O5S/c1-17-15-29(16-18(2)33-17)35(31,32)22-13-9-19(10-14-22)25(30)27-21-11-7-20(8-12-21)26-28-23-5-3-4-6-24(23)34-26/h3-14,17-18H,15-16H2,1-2H3,(H,27,30)

InChI Key

STLDSIWGICVZTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05023443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.083

Distribution Coefficient, logD

4.083

Water Solubility, LogSw

-4.19

Polar Surface Area

78.783

Acid Dissociation Constant (pKa)

11.14

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.10

3341-1856 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3341-1856 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3341-1856?
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What is the minimum amount of 3341-1856 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3341-1856
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3341-1856
  • 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 3341-1856 available by request