C370-4915 Screening compound: (6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

C370-4915 Screening compound: (6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
C370-4915 Screening compound: (6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C370-4915
(6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

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

C370-4915

Molecular Formula

C21H14FN5OS2 (C21 H14 FN5 OS2)

Compound Name

(6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6E)-6-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-5-imino-2-[(thiophen-2-yl)methyl]-5H6H7H-[134]thiadiazolo[32-a]pyrimidin-7-one

SMILES

N=C(/C1=C\c2cccn2-c(cccc2)c2F)N2N=C(Cc3cccs3)SC2=NC1=O

InChI

InChI=1S/C21H14FN5OS2/c22-16-7-1-2-8-17(16)26-9-3-5-13(26)11-15-19(23)27-21(24-20(15)28)30-18(25-27)12-14-6-4-10-29-14/h1-11,23H,12H2

InChI Key

VJFBBBNCICCOGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14754289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.718

Distribution Coefficient, logD

3.344

Water Solubility, LogSw

-4.27

Polar Surface Area

57.898

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

7.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

C370-4915 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C370-4915 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C370-4915?
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What is the minimum amount of C370-4915 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C370-4915
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C370-4915
  • 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 C370-4915 available by request