D511-0920 Screening compound: 2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1,2,3,4-tetrahydroisoquinoline

D511-0920 Screening compound: 2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1,2,3,4-tetrahydroisoquinoline
D511-0920 Screening compound: 2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound D511-0920
2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1,2,3,4-tetrahydroisoquinoline

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

D511-0920

Molecular Formula

C24H26N4O4S (C24 H26 N4 O4 S)

Compound Name

2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1H-pyrazole-3-carbonyl}-1234-tetrahydroisoquinoline

SMILES

COc(ccc(-c1cc(C(N(CC2)Cc3c2cccc3)=O)n[nH]1)c1)c1S(N1CCCC1)(=O)=O

InChI

InChI=1S/C24H26N4O4S/c1-32-22-9-8-18(14-23(22)33(30,31)28-11-4-5-12-28)20-15-21(26-25-20)24(29)27-13-10-17-6-2-3-7-19(17)16-27/h2-3,6-9,14-15H,4-5,10-13,16H2,1H3,(H,25,26)

InChI Key

OEMYDXVYBNKJPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27590179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.482

Distribution Coefficient, logD

3.482

Water Solubility, LogSw

-3.81

Polar Surface Area

78.746

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

-1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D511-0920 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D511-0920 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D511-0920?
Check Price and Availability of D511-0920, 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 D511-0920 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D511-0920
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D511-0920
  • 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 D511-0920 available by request