0934-0138 Screening compound: 3-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide

0934-0138 Screening compound: 3-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide
0934-0138 Screening compound: 3-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0934-0138
3-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]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

0934-0138

Molecular Formula

C17H13N3O4S (C17 H13 N3 O4 S)

Compound Name

3-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide

IUPAC name

3-methoxy-N-[4-(4-nitrophenyl)-13-thiazol-2-yl]benzamide

SMILES

COc1cccc(C(Nc2nc(-c(cc3)ccc3[N+]([O-])=O)cs2)=O)c1

InChI

InChI=1S/C17H13N3O4S/c1-24-14-4-2-3-12(9-14)16(21)19-17-18-15(10-25-17)11-5-7-13(8-6-11)20(22)23/h2-10H,1H3,(H,18,19,21)

InChI Key

YUPGWHRQORAOCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01341664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.626

Distribution Coefficient, logD

4.626

Water Solubility, LogSw

-4.55

Polar Surface Area

74.030

Acid Dissociation Constant (pKa)

10.85

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

0934-0138 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 0934-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0934-0138?
Check Price and Availability of 0934-0138, 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 0934-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0934-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0934-0138
  • 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 0934-0138 available by request