G755-0684 Screening compound: N-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide

G755-0684 Screening compound: N-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
G755-0684 Screening compound: N-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G755-0684
N-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide

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

G755-0684

Molecular Formula

C19H14ClN5O2S2 (C19 H14 ClN5 O2 S2)

Compound Name

N-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide

IUPAC name

N-{5-[({7-chloro-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]-134-thiadiazol-2-yl}-3-methylbenzamide

SMILES

Cc1cccc(C(Nc2nnc(SCC(N=C(C=C3)N4C=C3Cl)=CC4=O)s2)=O)c1

InChI

InChI=1S/C19H14ClN5O2S2/c1-11-3-2-4-12(7-11)17(27)22-18-23-24-19(29-18)28-10-14-8-16(26)25-9-13(20)5-6-15(25)21-14/h2-9H,10H2,1H3,(H,22,23,27)

InChI Key

GXGVXOVKTXIVMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27155975

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.94

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.550

Distribution Coefficient, logD

3.411

Water Solubility, LogSw

-4.05

Polar Surface Area

72.470

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with G755-0684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G755-0684?
Check Price and Availability of G755-0684, 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 G755-0684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G755-0684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G755-0684
  • 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 G755-0684 available by request