D148-0363 Screening compound: methyl 2-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

D148-0363 Screening compound: methyl 2-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate
D148-0363 Screening compound: methyl 2-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D148-0363
methyl 2-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

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

D148-0363

Molecular Formula

C18H13BrN4O3S (C18 H13 BrN4 O3 S)

Compound Name

methyl 2-[8-bromo-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate

IUPAC name

methyl 2-{12-bromo-1113-dimethyl-6-oxo-8-thia-34510-tetraazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-5-yl}benzoate

SMILES

Cc1c(c(N=NN(c(cccc2)c2C(OC)=O)C2=O)c2s2)c2nc(C)c1Br

InChI

InChI=1S/C18H13BrN4O3S/c1-8-12-14-15(27-16(12)20-9(2)13(8)19)17(24)23(22-21-14)11-7-5-4-6-10(11)18(25)26-3/h4-7H,1-3H3

InChI Key

MYMLFIUDUAGKDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812721

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.622

Distribution Coefficient, logD

4.622

Water Solubility, LogSw

-4.84

Polar Surface Area

68.432

Acid Dissociation Constant (pKa)

29.19

Base Dissociation Constant (pKb)

1.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with D148-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D148-0363?
Check Price and Availability of D148-0363, 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 D148-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D148-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D148-0363
  • 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 D148-0363 available by request