V014-6963 Screening compound: 6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-3,4-dihydropyrimidin-4-one

V014-6963 Screening compound: 6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-3,4-dihydropyrimidin-4-one
V014-6963 Screening compound: 6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-6963
6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-3,4-dihydropyrimidin-4-one

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

V014-6963

Molecular Formula

C26H31N7O5S (C26 H31 N7 O5 S)

Compound Name

6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-3,4-dihydropyrimidin-4-one

IUPAC name

6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(4-nitrobenzenesulfonyl)piperazin-1-yl]-34-dihydropyrimidin-4-one

SMILES

[O-][N+](c(cc1)ccc1S(N(CC1)CCN1C(N1)=NC(CN2CCN(Cc3ccccc3)CC2)=CC1=O)(=O)=O)=O

InChI

InChI=1S/C26H31N7O5S/c34-25-18-22(20-30-12-10-29(11-13-30)19-21-4-2-1-3-5-21)27-26(28-25)31-14-16-32(17-15-31)39(37,38)24-8-6-23(7-9-24)33(35)36/h1-9,18H,10-17,19-20H2,(H,27,28,34)

InChI Key

NTQOSRSYXZLKJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19860040

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

553.64

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

1.822

Distribution Coefficient, logD

0.035

Water Solubility, LogSw

-2.60

Polar Surface Area

110.536

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

8.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V014-6963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-6963?
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What is the minimum amount of V014-6963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-6963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-6963
  • 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 V014-6963 available by request