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CAS 115616-51-8 S-(2-thiopyridyl)mercaptopropionohydrazide molecular structure lightbox
CAS RN: 115616-51-8

S-(2-thiopyridyl)mercaptopropionohydrazide

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260205 100mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260310 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260506 250mg In stock Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250208 5g Out of stock Inquiry
  • Product code: SSC-015381
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 115616-51-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

115616-51-8 / 3-(pyridin-2-yldisulfanyl)propanehydrazide

TPMPH | Propanoic acid, 3-(2-pyridinyldithio)-, hydrazide | S-(2-Thiopyridyl)mercaptopropionohydrazide

Standard CAS: 115616-51-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
115616-51-8
Multi CAS
Yes
Molecular Formula
C8H11N3OS2
Molecular Weight
229.300000
Exact Mass
229.034354
SMILES
C1=CC=NC(=C1)SSCCC(=O)NN
InChI
InChI=1S/C8H11N3OS2/c9-11-7(12)4-6-13-14-8-3-1-2-5-10-8/h1-3,5H,4,6,9H2,(H,11,12)
InChIKey
NITXODYAMWZEJY-UHFFFAOYSA-N
Synonyms
TPMPH Propanoic acid, 3-(2-pyridinyldithio)-, hydrazide S-(2-Thiopyridyl)mercaptopropionohydrazide 3-(2-Pyridyldithio)propionic acid hydrazide DTXSID30151150

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
59.5
TPSA
68.01

LogP / Solubility

WLOGP
1.2
MLOGP
1.06
XLogP3
0.2
Consensus LogP
0.82
Log S (ESOL)
-2.01
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.31
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.75
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.27

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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