V010-2176 Screening compound: ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

V010-2176 Screening compound: ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
V010-2176 Screening compound: ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-2176
ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

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

V010-2176

Molecular Formula

C24H20ClN5O4 (C24 H20 ClN5 O4)

Compound Name

ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

IUPAC name

ethyl 5-[3-(2-chloro-6-methoxypyridine-4-amido)phenyl]-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

SMILES

CCOC(c(cc1-c2cccc(NC(c3cc(Cl)nc(OC)c3)=O)c2)nn1-c1ncccc1)=O

InChI

InChI=1S/C24H20ClN5O4/c1-3-34-24(32)18-14-19(30(29-18)21-9-4-5-10-26-21)15-7-6-8-17(11-15)27-23(31)16-12-20(25)28-22(13-16)33-2/h4-14H,3H2,1-2H3,(H,27,31)

InChI Key

KBENEXFJAPEZNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956432

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

477.91

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.056

Distribution Coefficient, logD

5.056

Water Solubility, LogSw

-5.22

Polar Surface Area

81.345

Acid Dissociation Constant (pKa)

11.29

Base Dissociation Constant (pKb)

2.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

V010-2176 in Drug Discovery

Included in Screening Libraries

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

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V010-2176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-2176?
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What is the minimum amount of V010-2176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-2176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-2176
  • 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 V010-2176 available by request