G755-0345 Screening compound: 1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}urea

G755-0345 Screening compound: 1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}urea
G755-0345 Screening compound: 1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G755-0345
1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}urea

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

G755-0345

Molecular Formula

C20H17ClN6O2S2 (C20 H17 ClN6 O2 S2)

Compound Name

1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}urea

IUPAC name

1-(5-chloro-2-methylphenyl)-3-{5-[({9-methyl-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]-134-thiadiazol-2-yl}urea

SMILES

Cc(ccc(Cl)c1)c1NC(Nc1nnc(SCC(N=C2N3C=CC=C2C)=CC3=O)s1)=O

InChI

InChI=1S/C20H17ClN6O2S2/c1-11-5-6-13(21)8-15(11)23-18(29)24-19-25-26-20(31-19)30-10-14-9-16(28)27-7-3-4-12(2)17(27)22-14/h3-9H,10H2,1-2H3,(H2,23,24,25,29)

InChI Key

NTQUVBOGYALBTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27155873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.294

Distribution Coefficient, logD

4.288

Water Solubility, LogSw

-4.63

Polar Surface Area

79.485

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with G755-0345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G755-0345?
Check Price and Availability of G755-0345, 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 G755-0345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G755-0345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G755-0345
  • 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 G755-0345 available by request