SC45-0938 Screening compound: N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-N'-(2-methoxyethyl)urea

SC45-0938 Screening compound: N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-N'-(2-methoxyethyl)urea
SC45-0938 Screening compound: N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-N'-(2-methoxyethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound SC45-0938
N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-N'-(2-methoxyethyl)urea

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

SC45-0938

Molecular Formula

C17H22N6O3 (C17 H22 N6 O3)

Compound Name

N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-N'-(2-methoxyethyl)urea

IUPAC name

1-({5-benzyl-6-oxo-4H5H6H7H-[123]triazolo[15-a]pyrazin-3-yl}methyl)-3-(2-methoxyethyl)urea

SMILES

COCCNC(NCc1c(CN(Cc2ccccc2)C(C2)=O)n2nn1)=O

InChI

InChI=1S/C17H22N6O3/c1-26-8-7-18-17(25)19-9-14-15-11-22(10-13-5-3-2-4-6-13)16(24)12-23(15)21-20-14/h2-6H,7-12H2,1H3,(H2,18,19,25)

InChI Key

FGSBNJMIHDFYGP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.643

Distribution Coefficient, logD

-0.643

Water Solubility, LogSw

-1.65

Polar Surface Area

87.215

Acid Dissociation Constant (pKa)

15.64

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with SC45-0938 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC45-0938?
Check Price and Availability of SC45-0938, 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 SC45-0938 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC45-0938
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC45-0938
  • 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 SC45-0938 available by request