V010-0603 Screening compound: ethyl 6-(6-chloropyridin-3-yl)-2-(3,3-dimethylbutanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate

V010-0603 Screening compound: ethyl 6-(6-chloropyridin-3-yl)-2-(3,3-dimethylbutanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate
V010-0603 Screening compound: ethyl 6-(6-chloropyridin-3-yl)-2-(3,3-dimethylbutanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-0603
ethyl 6-(6-chloropyridin-3-yl)-2-(3,3-dimethylbutanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-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

V010-0603

Molecular Formula

C21H26ClN3O3S (C21 H26 ClN3 O3 S)

Compound Name

ethyl 6-(6-chloropyridin-3-yl)-2-(3,3-dimethylbutanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate

IUPAC name

ethyl 6-(6-chloropyridin-3-yl)-2-(33-dimethylbutanamido)-4H5H6H7H-thieno[23-c]pyridine-3-carboxylate

SMILES

CCOC(c1c(NC(CC(C)(C)C)=O)sc(C2)c1CCN2c(cc1)cnc1Cl)=O

InChI

InChI=1S/C21H26ClN3O3S/c1-5-28-20(27)18-14-8-9-25(13-6-7-16(22)23-11-13)12-15(14)29-19(18)24-17(26)10-21(2,3)4/h6-7,11H,5,8-10,12H2,1-4H3,(H,24,26)

InChI Key

ZDSXFYHFYVYVFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956951

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

435.97

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.454

Distribution Coefficient, logD

1.454

Water Solubility, LogSw

-4.78

Polar Surface Area

56.055

Acid Dissociation Constant (pKa)

4.40

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

V010-0603 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V010-0603 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-0603?
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What is the minimum amount of V010-0603 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-0603
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-0603
  • 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 V010-0603 available by request