SC45-0625 Screening compound: N~2~-[(7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydro-2-naphthalenesulfonamide

SC45-0625 Screening compound: N~2~-[(7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydro-2-naphthalenesulfonamide
SC45-0625 Screening compound: N~2~-[(7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydro-2-naphthalenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC45-0625
N~2~-[(7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydro-2-naphthalenesulfonamide

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

SC45-0625

Molecular Formula

C17H21N5O3S (C17 H21 N5 O3 S)

Compound Name

N~2~-[(7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydro-2-naphthalenesulfonamide

IUPAC name

N-({7-methyl-6-oxo-4H5H6H7H-[123]triazolo[15-a]pyrazin-3-yl}methyl)-5678-tetrahydronaphthalene-2-sulfonamide

SMILES

CC1n2nnc(CNS(c3cc(CCCC4)c4cc3)(=O)=O)c2CNC1=O

InChI

InChI=1S/C17H21N5O3S/c1-11-17(23)18-10-16-15(20-21-22(11)16)9-19-26(24,25)14-7-6-12-4-2-3-5-13(12)8-14/h6-8,11,19H,2-5,9-10H2,1H3,(H,18,23)/t11-/m0/s1

InChI Key

NNPVKAMZSYLRHJ-NSHDSACASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.233

Distribution Coefficient, logD

1.205

Water Solubility, LogSw

-2.40

Polar Surface Area

93.274

Acid Dissociation Constant (pKa)

8.57

Base Dissociation Constant (pKb)

0.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.06

References: we are preparing a list of scientific research reports with SC45-0625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC45-0625?
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What is the minimum amount of SC45-0625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC45-0625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC45-0625
  • 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 SC45-0625 available by request