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CAS 36999-88-9 4-thiadiazol-2-amine,5,5’-dithiobis-3 molecular structure lightbox
CAS RN: 36999-88-9

4-thiadiazol-2-amine,5,5’-dithiobis-3

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260420 100mg In stock Shanghai Inquiry
Batchno.20251129 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20250611 1g In stock Shanghai Inquiry
Batchno.20260421 250mg In stock Shanghai, Tianjin Inquiry
  • Product code: starshine_CAS36999-88-9
  • Purity/Analytical Methods: >99.0%
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36999-88-9 / 5-[(5-amino-1,3,4-thiadiazol-2-yl)disulfanyl]-1,3,4-thiadiazol-2-amine

Standard CAS: 36999-88-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
36999-88-9
Multi CAS
No
Molecular Formula
C4H4N6S4
Molecular Weight
264.400000
Exact Mass
263.938029
InChI
InChI=1S/C4H4N6S4/c5-1-7-9-3(11-1)13-14-4-10-8-2(6)12-4/h(H2,5,7)(H2,6,8)
InChIKey
SYZMRQPVVFJNHQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Rotatable bonds
3
H-bond acceptors
10
H-bond donors
2
Molar refractivity
60.36
TPSA
103.6

LogP / Solubility

WLOGP
1.35
MLOGP
1.2
XLogP3
0.9
Consensus LogP
1.15
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.37

Drug-likeness / Medicinal Chemistry

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

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