E235-3050 Screening compound: 2-(2,4-dimethylphenyl)-N~7~-(3-isopropoxypropyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

E235-3050 Screening compound: 2-(2,4-dimethylphenyl)-N~7~-(3-isopropoxypropyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide
E235-3050 Screening compound: 2-(2,4-dimethylphenyl)-N~7~-(3-isopropoxypropyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E235-3050
2-(2,4-dimethylphenyl)-N~7~-(3-isopropoxypropyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

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

E235-3050

Molecular Formula

C24H27N3O2S (C24 H27 N3 O2 S)

Compound Name

2-(2,4-dimethylphenyl)-N~7~-(3-isopropoxypropyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

IUPAC name

4-(24-dimethylphenyl)-N-[3-(propan-2-yloxy)propyl]-7-thia-25-diazatricyclo[6.4.0.0^{26}]dodeca-1(12)35810-pentaene-10-carboxamide

SMILES

CC(C)OCCCNC(c(cc1)cc(s2)c1n1c2nc(-c2c(C)cc(C)cc2)c1)=O

InChI

InChI=1S/C24H27N3O2S/c1-15(2)29-11-5-10-25-23(28)18-7-9-21-22(13-18)30-24-26-20(14-27(21)24)19-8-6-16(3)12-17(19)4/h6-9,12-15H,5,10-11H2,1-4H3,(H,25,28)

InChI Key

MKLUAKODQHCPRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14851815

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.894

Distribution Coefficient, logD

4.870

Water Solubility, LogSw

-4.36

Polar Surface Area

40.672

Acid Dissociation Constant (pKa)

14.49

Base Dissociation Constant (pKb)

6.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with E235-3050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E235-3050?
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What is the minimum amount of E235-3050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E235-3050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E235-3050
  • 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 E235-3050 available by request