M152-1667 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazin-6-yl]acetamide

M152-1667 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazin-6-yl]acetamide
M152-1667 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazin-6-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M152-1667
N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazin-6-yl]acetamide

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

M152-1667

Molecular Formula

C18H16ClFN4O3S (C18 H16 ClFN4 O3 S)

Compound Name

N-[(3-chloro-4-fluorophenyl)methyl]-2-[3,5-dioxo-4-(prop-2-en-1-yl)-2H,3H,4H,5H,6H-pyridazino[4,5-b][1,4]thiazin-6-yl]acetamide

IUPAC name

N-[(3-chloro-4-fluorophenyl)methyl]-2-[35-dioxo-4-(prop-2-en-1-yl)-2H3H4H5H6H-pyridazino[45-b][14]thiazin-6-yl]acetamide

SMILES

C=CCN1C(C(N(CC(NCc(cc2)cc(Cl)c2F)=O)N=C2)=O)=C2SCC1=O

InChI

InChI=1S/C18H16ClFN4O3S/c1-2-5-23-16(26)10-28-14-8-22-24(18(27)17(14)23)9-15(25)21-7-11-3-4-13(20)12(19)6-11/h2-4,6,8H,1,5,7,9-10H2,(H,21,25)

InChI Key

UFUFGZAVZWWZSY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27533099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.87

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.030

Distribution Coefficient, logD

2.030

Water Solubility, LogSw

-2.92

Polar Surface Area

68.837

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-0.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

M152-1667 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with M152-1667 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M152-1667?
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What is the minimum amount of M152-1667 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M152-1667
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M152-1667
  • 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 M152-1667 available by request