V021-4345 Screening compound: 6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-amine

V021-4345 Screening compound: 6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-amine
V021-4345 Screening compound: 6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-4345
6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-amine

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

V021-4345

Molecular Formula

C27H33ClN6O2S (C27 H33 ClN6 O2 S)

Compound Name

6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-amine

IUPAC name

6-(3-chlorobenzenesulfonyl)-N-methyl-2-(4-phenylpiperazin-1-yl)-N-(propan-2-yl)-5H6H7H8H-pyrido[43-d]pyrimidin-4-amine

SMILES

CC(C)N(C)c1c(CN(CC2)S(c3cccc(Cl)c3)(=O)=O)c2nc(N(CC2)CCN2c2ccccc2)n1

InChI

InChI=1S/C27H33ClN6O2S/c1-20(2)31(3)26-24-19-34(37(35,36)23-11-7-8-21(28)18-23)13-12-25(24)29-27(30-26)33-16-14-32(15-17-33)22-9-5-4-6-10-22/h4-11,18,20H,12-17,19H2,1-3H3

InChI Key

RRCONJZFMBMXHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19908888

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

541.12

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.529

Distribution Coefficient, logD

5.528

Water Solubility, LogSw

-5.85

Polar Surface Area

60.033

Acid Dissociation Constant (pKa)

20.31

Base Dissociation Constant (pKb)

4.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V021-4345 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V021-4345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-4345?
Check Price and Availability of V021-4345, 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 V021-4345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-4345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-4345
  • 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 V021-4345 available by request