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CAS 64461-82-1 Tizanidine Hydrochloride molecular structure lightbox
CAS RN: 64461-82-1

Tizanidine Hydrochloride

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7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250617 1g In stock Inquiry
Batchno.20250928 25g In stock Inquiry
Batchno.20250710 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250411 100g In stock Shanghai Inquiry
Batchno.20250131 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260611 25g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250322 5g In stock Shanghai, Shenzhen Inquiry
  • Product code: ICTT2527
  • Purity/Analytical Methods: >98.0%(T)(HPLC)
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64461-82-1 / 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2,1,3-benzothiadiazol-4-amine;hydrochloride

Standard CAS: 64461-82-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
64461-82-1
Multi CAS
Yes
Molecular Formula
C9H9CL2N5S
Molecular Weight
290.170000
Exact Mass
288.995572
InChI
InChI=1S/C9H8ClN5S.ClH/c10-5-1-2-6-8(15-16-14-6)7(5)13-9-11-3-4-12-9;/h1-2H,3-4H2,(H2,11,12,13);1H
InChIKey
ZWUKMNZJRDGCTQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
9
Fraction Csp3
0.22
Rotatable bonds
1
H-bond acceptors
6
H-bond donors
2
Molar refractivity
73.6
TPSA
62.2

LogP / Solubility

WLOGP
2.14
MLOGP
1.89
XLogP3
2.14
Consensus LogP
2.06
Log S (ESOL)
-3.31
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.48
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.44
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.97

Drug-likeness / Medicinal Chemistry

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

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