L350-0399 Screening compound: N-(tert-butyl)-N-[2-(2-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-3-yl]amine

L350-0399 Screening compound: N-(tert-butyl)-N-[2-(2-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-3-yl]amine
L350-0399 Screening compound: N-(tert-butyl)-N-[2-(2-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-3-yl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound L350-0399
N-(tert-butyl)-N-[2-(2-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-3-yl]amine

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

L350-0399

Molecular Formula

C19H18FN3S (C19 H18 FN3 S)

Compound Name

N-(tert-butyl)-N-[2-(2-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-3-yl]amine

IUPAC name

N-tert-butyl-4-(2-fluorophenyl)-7-thia-25-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)35911-pentaen-3-amine

SMILES

CC(C)(C)Nc1c(-c(cccc2)c2F)nc2sc(cccc3)c3n12

InChI

InChI=1S/C19H18FN3S/c1-19(2,3)22-17-16(12-8-4-5-9-13(12)20)21-18-23(17)14-10-6-7-11-15(14)24-18/h4-11,22H,1-3H3

InChI Key

CMYBYXQNWRCEJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27247644

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.44

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.489

Distribution Coefficient, logD

5.444

Water Solubility, LogSw

-5.77

Polar Surface Area

18.244

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

6.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

L350-0399 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L350-0399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L350-0399?
Check Price and Availability of L350-0399, 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 L350-0399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L350-0399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L350-0399
  • 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 L350-0399 available by request