J077-0934 Screening compound: 1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one

J077-0934 Screening compound: 1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one
J077-0934 Screening compound: 1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J077-0934
1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-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

J077-0934

Molecular Formula

C30H34N4O3 (C30 H34 N4 O3)

Compound Name

1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one

IUPAC name

1-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-13-diazinan-2-one

SMILES

Cc1ccc(CN(CCCN2c3cc(C(N(CC4)CCN4c(cc4)ccc4OC)=O)ccc3)C2=O)cc1

InChI

InChI=1S/C30H34N4O3/c1-23-7-9-24(10-8-23)22-33-15-4-16-34(30(33)36)27-6-3-5-25(21-27)29(35)32-19-17-31(18-20-32)26-11-13-28(37-2)14-12-26/h3,5-14,21H,4,15-20,22H2,1-2H3

InChI Key

IWJZFRQUCREWNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14856711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.497

Distribution Coefficient, logD

4.497

Water Solubility, LogSw

-4.36

Polar Surface Area

47.249

Acid Dissociation Constant (pKa)

27.49

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with J077-0934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J077-0934?
Check Price and Availability of J077-0934, 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 J077-0934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J077-0934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J077-0934
  • 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 J077-0934 available by request