D148-0251 Screening compound: 3-(3-chloro-4-methylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one

D148-0251 Screening compound: 3-(3-chloro-4-methylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
D148-0251 Screening compound: 3-(3-chloro-4-methylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D148-0251
3-(3-chloro-4-methylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-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

D148-0251

Molecular Formula

C18H15ClN4O2S (C18 H15 ClN4 O2 S)

Compound Name

3-(3-chloro-4-methylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one

IUPAC name

5-(3-chloro-4-methylphenyl)-13-(methoxymethyl)-11-methyl-8-thia-34510-tetraazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-6-one

SMILES

Cc(ccc(N(C1=O)N=Nc2c1sc1c2c(COC)cc(C)n1)c1)c1Cl

InChI

InChI=1S/C18H15ClN4O2S/c1-9-4-5-12(7-13(9)19)23-18(24)16-15(21-22-23)14-11(8-25-3)6-10(2)20-17(14)26-16/h4-7H,8H2,1-3H3

InChI Key

ZHCAEJKEGLEWPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812716

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.739

Distribution Coefficient, logD

4.739

Water Solubility, LogSw

-4.90

Polar Surface Area

55.212

Acid Dissociation Constant (pKa)

28.26

Base Dissociation Constant (pKb)

2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with D148-0251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D148-0251?
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What is the minimum amount of D148-0251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D148-0251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D148-0251
  • 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 D148-0251 available by request