J077-1329 Screening compound: 3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide

J077-1329 Screening compound: 3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide
J077-1329 Screening compound: 3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J077-1329
3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide

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

J077-1329

Molecular Formula

C25H25N3O3 (C25 H25 N3 O3)

Compound Name

3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide

IUPAC name

3-(3-benzyl-2-oxo-13-diazinan-1-yl)-N-(2-methoxyphenyl)benzamide

SMILES

COc(cccc1)c1NC(c1cccc(N(CCCN2Cc3ccccc3)C2=O)c1)=O

InChI

InChI=1S/C25H25N3O3/c1-31-23-14-6-5-13-22(23)26-24(29)20-11-7-12-21(17-20)28-16-8-15-27(25(28)30)18-19-9-3-2-4-10-19/h2-7,9-14,17H,8,15-16,18H2,1H3,(H,26,29)

InChI Key

QHOXSUOQWBUWCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.288

Distribution Coefficient, logD

4.288

Water Solubility, LogSw

-4.28

Polar Surface Area

49.821

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with J077-1329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J077-1329?
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What is the minimum amount of J077-1329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J077-1329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J077-1329
  • 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 J077-1329 available by request