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CAS 132-17-2 Benztropine Mesylate molecular structure lightbox
CAS RN: 132-17-2

Benztropine Mesylate

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251218 1ml In stock Inquiry
  • Product code: SSC-039048
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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: 5g
  • 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 132-17-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

132-17-2 / (1R,5S)-3-benzhydryloxy-8-methyl-8-azabicyclo[3.2.1]octane;methanesulfonic acid

Standard CAS: 132-17-2 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
132-17-2
Multi CAS
No
Molecular Formula
C22H29NO4S
Molecular Weight
403.500000
Exact Mass
403.181730
SMILES
CN1[C@@H]2CC[C@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O
InChI
InChI=1S/C21H25NO.CH4O3S/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17;1-5(2,3)4/h2-11,18-21H,12-15H2,1H3;1H3,(H,2,3,4)/t18-,19+,20?;
InChIKey
CPFJLLXFNPCTDW-IIPFOPBBSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
12
Fraction Csp3
0.45
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
110.88
TPSA
66.84

LogP / Solubility

WLOGP
3.92
MLOGP
3.48
XLogP3
3.92
Consensus LogP
3.77
Log S (ESOL)
-4.87
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.7
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.02
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6

Safety & Transport

Pictogram(s)
Acute Toxic Health Hazard
Signal
Danger
GHS Hazard Statements
H300 (46.1%): Fatal if swallowed [Danger Acute toxicity, oral] H301 (52.6%): Toxic if swallowed [Danger Acute toxicity, oral] H311 (52.6%): Toxic in contact with skin [Danger Acute toxicity, dermal] H331 (52.6%): Toxic if inhaled [Danger Acute toxicity, inhalation] H370 (46.1%): Causes damage to organs [Danger Specific target organ toxicity, single exposure]
Precautionary Statement Codes
P260, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P308+P316, P316, P319, P321, P330, P361+P364, P403+P233, P405, and P501

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