V027-6438 Screening compound: N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide

V027-6438 Screening compound: N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide
V027-6438 Screening compound: N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-6438
N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide

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

V027-6438

Molecular Formula

C27H35ClN6O (C27 H35 ClN6 O)

Compound Name

N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide

IUPAC name

N-(4-{[6-(butan-2-yl)-1-(2-chlorophenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]amino}cyclohexyl)cyclopentanecarboxamide

SMILES

CCC(C)c1nc(NC(CC2)CCC2NC(C2CCCC2)=O)c(cnn2-c(cccc3)c3Cl)c2n1

InChI

InChI=1S/C27H35ClN6O/c1-3-17(2)24-32-25(21-16-29-34(26(21)33-24)23-11-7-6-10-22(23)28)30-19-12-14-20(15-13-19)31-27(35)18-8-4-5-9-18/h6-7,10-11,16-20H,3-5,8-9,12-15H2,1-2H3,(H,31,35)(H,30,32,33)/t17-,19?,20?/m0/s1

InChI Key

RZYMEBJAOVRMFM-KKXNLOMOSA-N

MDL Number (MFCD)

MFCD14254649

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

495.07

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.243

Distribution Coefficient, logD

6.224

Water Solubility, LogSw

-6.05

Polar Surface Area

68.040

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

6.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

V027-6438 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V027-6438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-6438?
Check Price and Availability of V027-6438, 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 V027-6438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-6438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-6438
  • 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 V027-6438 available by request