M152-0276 Screening compound: 4-methyl-6-[2-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazine-3,5-dione

M152-0276 Screening compound: 4-methyl-6-[2-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazine-3,5-dione
M152-0276 Screening compound: 4-methyl-6-[2-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound M152-0276
4-methyl-6-[2-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazine-3,5-dione

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

M152-0276

Molecular Formula

C18H18N4O4S (C18 H18 N4 O4 S)

Compound Name

4-methyl-6-[2-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazine-3,5-dione

IUPAC name

4-methyl-6-[2-(6-methyl-34-dihydro-2H-14-benzoxazin-4-yl)-2-oxoethyl]-2H3H4H5H6H-pyridazino[45-b][14]thiazine-35-dione

SMILES

Cc(cc1)cc2c1OCCN2C(CN(C1=O)N=CC(SC2)=C1N(C)C2=O)=O

InChI

InChI=1S/C18H18N4O4S/c1-11-3-4-13-12(7-11)21(5-6-26-13)15(23)9-22-18(25)17-14(8-19-22)27-10-16(24)20(17)2/h3-4,7-8H,5-6,9-10H2,1-2H3

InChI Key

WPHWLCOLOAAZDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27532814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.001

Distribution Coefficient, logD

1.001

Water Solubility, LogSw

-2.38

Polar Surface Area

67.161

Acid Dissociation Constant (pKa)

17.25

Base Dissociation Constant (pKb)

-0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M152-0276 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M152-0276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M152-0276?
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What is the minimum amount of M152-0276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M152-0276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M152-0276
  • 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 M152-0276 available by request