M330-0805 Screening compound: N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide

M330-0805 Screening compound: N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
M330-0805 Screening compound: N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M330-0805
N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide

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

M330-0805

Molecular Formula

C20H20ClFN4O4S2 (C20 H20 ClFN4 O4 S2)

Compound Name

N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide

IUPAC name

N-(4-chloro-2-fluorophenyl)-1-methyl-5-[4-methyl-5-(morpholine-4-carbonyl)-13-thiazol-2-yl]-1H-pyrrole-3-sulfonamide

SMILES

Cc1c(C(N2CCOCC2)=O)sc(-c2cc(S(Nc(ccc(Cl)c3)c3F)(=O)=O)cn2C)n1

InChI

InChI=1S/C20H20ClFN4O4S2/c1-12-18(20(27)26-5-7-30-8-6-26)31-19(23-12)17-10-14(11-25(17)2)32(28,29)24-16-4-3-13(21)9-15(16)22/h3-4,9-11,24H,5-8H2,1-2H3

InChI Key

WEMCEIHZWFQRDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27536362

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.99

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.238

Distribution Coefficient, logD

2.194

Water Solubility, LogSw

-3.66

Polar Surface Area

77.368

Acid Dissociation Constant (pKa)

6.40

Base Dissociation Constant (pKb)

1.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M330-0805 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M330-0805 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M330-0805?
Check Price and Availability of M330-0805, 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 M330-0805 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M330-0805
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M330-0805
  • 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 M330-0805 available by request