3015-0016 Screening compound: 1-(1,3-benzothiazol-2-ylsulfanyl)-3-(3,6-dibromo-9H-carbazol-9-yl)-2-propanol

3015-0016 Screening compound: 1-(1,3-benzothiazol-2-ylsulfanyl)-3-(3,6-dibromo-9H-carbazol-9-yl)-2-propanol
3015-0016 Screening compound: 1-(1,3-benzothiazol-2-ylsulfanyl)-3-(3,6-dibromo-9H-carbazol-9-yl)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3015-0016
1-(1,3-benzothiazol-2-ylsulfanyl)-3-(3,6-dibromo-9H-carbazol-9-yl)-2-propanol

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

3015-0016

Molecular Formula

C22H16Br2N2OS2 (C22 H16 Br2 N2 OS2)

Compound Name

1-(1,3-benzothiazol-2-ylsulfanyl)-3-(3,6-dibromo-9H-carbazol-9-yl)-2-propanol

IUPAC name

1-(13-benzothiazol-2-ylsulfanyl)-3-(36-dibromo-9H-carbazol-9-yl)propan-2-ol

SMILES

OC(Cn1c(ccc(Br)c2)c2c2c1ccc(Br)c2)CSc1nc(cccc2)c2s1

InChI

InChI=1S/C22H16Br2N2OS2/c23-13-5-7-19-16(9-13)17-10-14(24)6-8-20(17)26(19)11-15(27)12-28-22-25-18-3-1-2-4-21(18)29-22/h1-10,15,27H,11-12H2/t15-/m0/s1

InChI Key

GAPYRKMJSPKLBA-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD02046279

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

548.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.723

Distribution Coefficient, logD

7.723

Water Solubility, LogSw

-6.31

Polar Surface Area

26.643

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.64

3015-0016 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3015-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3015-0016?
Check Price and Availability of 3015-0016, 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 3015-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3015-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3015-0016
  • 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 3015-0016 available by request