M039-0331 Screening compound: N-(4-chloro-2-methoxy-5-methylphenyl)-5-{5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}-2-methoxybenzene-1-sulfonamide

M039-0331 Screening compound: N-(4-chloro-2-methoxy-5-methylphenyl)-5-{5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}-2-methoxybenzene-1-sulfonamide
M039-0331 Screening compound: N-(4-chloro-2-methoxy-5-methylphenyl)-5-{5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}-2-methoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M039-0331
N-(4-chloro-2-methoxy-5-methylphenyl)-5-{5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}-2-methoxybenzene-1-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

M039-0331

Molecular Formula

C23H23ClN4O4S (C23 H23 ClN4 O4 S)

Compound Name

N-(4-chloro-2-methoxy-5-methylphenyl)-5-{5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}-2-methoxybenzene-1-sulfonamide

IUPAC name

N-(4-chloro-2-methoxy-5-methylphenyl)-5-{57-dimethylpyrazolo[15-a]pyrimidin-3-yl}-2-methoxybenzene-1-sulfonamide

SMILES

Cc(cc(c(OC)c1)NS(c(cc(cc2)-c3c4nc(C)cc(C)n4nc3)c2OC)(=O)=O)c1Cl

InChI

InChI=1S/C23H23ClN4O4S/c1-13-8-19(21(32-5)11-18(13)24)27-33(29,30)22-10-16(6-7-20(22)31-4)17-12-25-28-15(3)9-14(2)26-23(17)28/h6-12,27H,1-5H3

InChI Key

HTQPSVXYDLLOCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27494119

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.98

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

4.647

Distribution Coefficient, logD

2.380

Water Solubility, LogSw

-5.00

Polar Surface Area

75.157

Acid Dissociation Constant (pKa)

5.14

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.74

References: we are preparing a list of scientific research reports with M039-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M039-0331?
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What is the minimum amount of M039-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M039-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M039-0331
  • 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 M039-0331 available by request