SD67-0518 Screening compound: 2-benzyl-N~9~-isopropyl-1,4-dioxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide

SD67-0518 Screening compound: 2-benzyl-N~9~-isopropyl-1,4-dioxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide
SD67-0518 Screening compound: 2-benzyl-N~9~-isopropyl-1,4-dioxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD67-0518
2-benzyl-N~9~-isopropyl-1,4-dioxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide

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

SD67-0518

Molecular Formula

C19H26N4O3 (C19 H26 N4 O3)

Compound Name

2-benzyl-N~9~-isopropyl-1,4-dioxooctahydropyrazino[1,2-a][1,4]diazepine-9(6H)-carboxamide

IUPAC name

n/a

SMILES

CC(C)NC(N(CCC1)CC(C(N(Cc2ccccc2)C2)=O)N1C2=O)=O

InChI

InChI=1S/C19H26N4O3/c1-14(2)20-19(26)21-9-6-10-23-16(12-21)18(25)22(13-17(23)24)11-15-7-4-3-5-8-15/h3-5,7-8,14,16H,6,9-13H2,1-2H3,(H,20,26)/t16-/m0/s1

InChI Key

ZDDKQAHRPCJZHL-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.880

Distribution Coefficient, logD

0.880

Water Solubility, LogSw

-1.86

Polar Surface Area

59.412

Acid Dissociation Constant (pKa)

16.75

Base Dissociation Constant (pKb)

2.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.63

References: we are preparing a list of scientific research reports with SD67-0518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD67-0518?
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What is the minimum amount of SD67-0518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD67-0518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD67-0518
  • 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 SD67-0518 available by request