G857-1277 Screening compound: 1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]ethan-1-one

G857-1277 Screening compound: 1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]ethan-1-one
G857-1277 Screening compound: 1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-1277
1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]ethan-1-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

G857-1277

Molecular Formula

C15H13N5O4S (C15 H13 N5 O4 S)

Compound Name

1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]ethan-1-one

IUPAC name

1-[7-acetyl-3-methyl-6-(4-nitrophenyl)-5H-[124]triazolo[34-b][134]thiadiazin-5-yl]ethan-1-one

SMILES

CC(C(S1)=C(c(cc2)ccc2[N+]([O-])=O)N(C(C)=O)n2c1nnc2C)=O

InChI

InChI=1S/C15H13N5O4S/c1-8(21)14-13(11-4-6-12(7-5-11)20(23)24)19(10(3)22)18-9(2)16-17-15(18)25-14/h4-7H,1-3H3

InChI Key

CPQMYJCKVAGECP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06733037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.37

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.299

Distribution Coefficient, logD

1.299

Water Solubility, LogSw

-2.26

Polar Surface Area

87.845

Acid Dissociation Constant (pKa)

19.73

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with G857-1277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-1277?
Check Price and Availability of G857-1277, 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 G857-1277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-1277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-1277
  • 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 G857-1277 available by request