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CAS 117736-74-0 3-(Methylthio)-1H-pyrazol-5-amine molecular structure lightbox
CAS RN: 117736-74-0

3-(Methylthio)-1H-pyrazol-5-amine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250831 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-017589
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 0.1g, 0.25g
  • Available purity: ≥97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 117736-74-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Hong Kong Inquiry
5g ≥97% 1 In Stock Shenzhen Inquiry
0.1g ≥97% 0 Out of Stock Shanghai Inquiry
0.25g ≥97% 0 Out of Stock Hong Kong Inquiry

117736-74-0 / 3-methylsulfanyl-1H-pyrazol-5-amine

3-(Methylthio)-1H-pyrazol-5-amine | 3-methylsulfanyl-1H-pyrazol-5-amine | MFCD18642411

Standard CAS: 117736-74-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
117736-74-0
Multi CAS
No
Molecular Formula
C4H7N3S
Molecular Weight
129.190000
Exact Mass
129.036068
SMILES
CSC1=NNC(=C1)N
InChI
InChI=1S/C4H7N3S/c1-8-4-2-3(5)6-7-4/h2H,1H3,(H3,5,6,7)
InChIKey
NPBDQUSJACEGDI-UHFFFAOYSA-N
Synonyms
3-(Methylthio)-1H-pyrazol-5-amine 3-methylsulfanyl-1H-pyrazol-5-amine MFCD18642411 5-Amino-3-(methylthio)-1H-pyrazole 5-(methylthio)-1H-Pyrazol-3-amine

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
34.78
TPSA
54.7

LogP / Solubility

WLOGP
0.71
MLOGP
0.62
XLogP3
0.7
Consensus LogP
0.68
Log S (ESOL)
-1.49
Class (ESOL)
Soluble
Log S (Ali)
-1.13
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.21
Class (SILICOS-IT)
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

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501

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