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CAS 3663-61-4 1H-1,2,4-Triazol-3-amine,5-(2-furanyl)-(9CI) molecular structure lightbox
CAS RN: 3663-61-4

1H-1,2,4-Triazol-3-amine,5-(2-furanyl)-(9CI)

  • Product code: SSC-143842
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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, 0.25g, 0.1g, 5g, 10g
  • Available purity: ≥97%
  • Inventory rows with stock: 10
  • 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 3663-61-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 4 In Stock Shenzhen Inquiry
1g ≥97% 4 In Stock Hong Kong Inquiry
0.25g -- 3 In Stock Beijing Inquiry
0.25g ≥97% 3 In Stock Beijing Inquiry
0.1g -- 2 In Stock Beijing Inquiry
0.1g ≥97% 2 In Stock Shenzhen Inquiry
5g -- 2 In Stock Shenzhen Inquiry
5g ≥97% 2 In Stock Shenzhen Inquiry
10g -- 1 In Stock Beijing Inquiry
10g ≥97% 1 In Stock Shenzhen Inquiry

3663-61-4 / 5-(furan-2-yl)-1H-1,2,4-triazol-3-amine

Standard CAS: 3663-61-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
3663-61-4
Multi CAS
No
Molecular Formula
C6H6N4O
Molecular Weight
150.140000
Exact Mass
150.054161
InChI
InChI=1S/C6H6N4O/c7-6-8-5(9-10-6)4-2-1-3-11-4/h1-3H,(H3,7,8,9,10)
InChIKey
PXCDIRKSCUAMKA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
38.5
TPSA
80.73

LogP / Solubility

WLOGP
0.65
MLOGP
0.56
XLogP3
0.4
Consensus LogP
0.54
Log S (ESOL)
-1.79
Class (ESOL)
Soluble
Log S (Ali)
-1.26
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.29
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.18

Drug-likeness / Medicinal Chemistry

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

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