8004-8015 Screening compound: (E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]methanimine

8004-8015 Screening compound: (E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]methanimine
8004-8015 Screening compound: (E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-8015
(E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]methanimine

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

8004-8015

Molecular Formula

C15H11BrN2OS2 (C15 H11 BrN2 OS2)

Compound Name

(E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]methanimine

IUPAC name

(E)-1-(5-bromofuran-2-yl)-N-[2-(prop-2-en-1-ylsulfanyl)-13-benzothiazol-6-yl]methanimine

SMILES

C=CCSc1nc(ccc(/N=C/c(o2)ccc2Br)c2)c2s1

InChI

InChI=1S/C15H11BrN2OS2/c1-2-7-20-15-18-12-5-3-10(8-13(12)21-15)17-9-11-4-6-14(16)19-11/h2-6,8-9H,1,7H2

InChI Key

RXRMSHXUSRBXGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00501158

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.341

Distribution Coefficient, logD

5.341

Water Solubility, LogSw

-5.77

Polar Surface Area

25.544

Acid Dissociation Constant (pKa)

28.45

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

8004-8015 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8004-8015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-8015?
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What is the minimum amount of 8004-8015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-8015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-8015
  • 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 8004-8015 available by request