V019-2631 Screening compound: 1-(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol

V019-2631 Screening compound: 1-(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol
V019-2631 Screening compound: 1-(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-2631
1-(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol

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

V019-2631

Molecular Formula

C22H31N5O3 (C22 H31 N5 O3)

Compound Name

1-(4-{2,6-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol

IUPAC name

1-(4-{26-dimethyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)pentan-2-ol

SMILES

CCCC(CN(CC1)CCN1c1c(Cc(cc2)ccc2[N+]([O-])=O)c(C)nc(C)n1)O

InChI

InChI=1S/C22H31N5O3/c1-4-5-20(28)15-25-10-12-26(13-11-25)22-21(16(2)23-17(3)24-22)14-18-6-8-19(9-7-18)27(29)30/h6-9,20,28H,4-5,10-15H2,1-3H3/t20-/m0/s1

InChI Key

SERPOPDKEJRNJA-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19885103

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.701

Distribution Coefficient, logD

3.437

Water Solubility, LogSw

-4.01

Polar Surface Area

75.926

Acid Dissociation Constant (pKa)

16.66

Base Dissociation Constant (pKb)

7.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with V019-2631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-2631?
Check Price and Availability of V019-2631, 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 V019-2631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-2631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-2631
  • 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 V019-2631 available by request