M061-0045 Screening compound: 1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl}-4-methylpiperazine

M061-0045 Screening compound: 1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl}-4-methylpiperazine
M061-0045 Screening compound: 1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl}-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M061-0045
1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl}-4-methylpiperazine

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

M061-0045

Molecular Formula

C25H32N6O4S (C25 H32 N6 O4 S)

Compound Name

1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl}-4-methylpiperazine

IUPAC name

1-{3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-57-dimethylpyrazolo[15-a]pyrimidine-2-carbonyl}-4-methylpiperazine

SMILES

Cc(n1nc2C(N3CCN(C)CC3)=O)cc(C)nc1c2-c(cc1)cc(S(N2CCCC2)(=O)=O)c1OC

InChI

InChI=1S/C25H32N6O4S/c1-17-15-18(2)31-24(26-17)22(23(27-31)25(32)29-13-11-28(3)12-14-29)19-7-8-20(35-4)21(16-19)36(33,34)30-9-5-6-10-30/h7-8,15-16H,5-6,9-14H2,1-4H3

InChI Key

WTJGMEFGJPLURC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.63

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.438

Distribution Coefficient, logD

1.306

Water Solubility, LogSw

-2.34

Polar Surface Area

80.324

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

M061-0045 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M061-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M061-0045?
Check Price and Availability of M061-0045, 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 M061-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M061-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M061-0045
  • 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 M061-0045 available by request