V015-0195 Screening compound: 1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazine

V015-0195 Screening compound: 1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazine
V015-0195 Screening compound: 1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-0195
1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazine

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

V015-0195

Molecular Formula

C30H28ClN7O4S (C30 H28 ClN7 O4 S)

Compound Name

1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazine

IUPAC name

1-(4-chloro-3-nitrobenzenesulfonyl)-4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[34-d]pyrimidin-4-yl}piperazine

SMILES

Cc(c1c2nc(Cc3ccc(C)cc3)nc1N(CC1)CCN1S(c(cc1)cc([N+]([O-])=O)c1Cl)(=O)=O)nn2-c1ccccc1

InChI

InChI=1S/C30H28ClN7O4S/c1-20-8-10-22(11-9-20)18-27-32-29(28-21(2)34-37(30(28)33-27)23-6-4-3-5-7-23)35-14-16-36(17-15-35)43(41,42)24-12-13-25(31)26(19-24)38(39)40/h3-13,19H,14-18H2,1-2H3

InChI Key

SAKZLMZSPVFZBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19856942

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

618.12

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

6.169

Distribution Coefficient, logD

6.067

Water Solubility, LogSw

-6.19

Polar Surface Area

102.293

Acid Dissociation Constant (pKa)

21.40

Base Dissociation Constant (pKb)

6.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.30

V015-0195 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V015-0195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-0195?
Check Price and Availability of V015-0195, 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 V015-0195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-0195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-0195
  • 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 V015-0195 available by request