1319-0215 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine

1319-0215 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine
1319-0215 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1319-0215
(2Z)-3-(1H-1,3-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine

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

1319-0215

Molecular Formula

C24H16F3N3O2 (C24 H16 F3 N3 O2)

Compound Name

(2Z)-3-(1H-1,3-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine

IUPAC name

(2Z)-3-(1H-13-benzodiazol-2-yl)-7-methoxy-N-[3-(trifluoromethyl)phenyl]-2H-chromen-2-imine

SMILES

COc(cc1)cc(O2)c1C=C(c1nc(cccc3)c3[nH]1)/C2=N/c1cccc(C(F)(F)F)c1

InChI

InChI=1S/C24H16F3N3O2/c1-31-17-10-9-14-11-18(22-29-19-7-2-3-8-20(19)30-22)23(32-21(14)13-17)28-16-6-4-5-15(12-16)24(25,26)27/h2-13H,1H3,(H,29,30)

InChI Key

VDGBYOACYDQJEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.690

Distribution Coefficient, logD

4.517

Water Solubility, LogSw

-5.74

Polar Surface Area

42.508

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

8.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

1319-0215 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1319-0215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1319-0215?
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What is the minimum amount of 1319-0215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1319-0215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1319-0215
  • 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 1319-0215 available by request