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CAS 51488-33-6 3,4-DIMETHOXY-BENZAMIDINE HCL molecular structure lightbox
CAS RN: 51488-33-6

3,4-DIMETHOXY-BENZAMIDINE HCL

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251102 100mg / 250mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-158346
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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: 1g
  • Available purity: ＞97%
  • 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 51488-33-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

51488-33-6 / [amino-(3,4-dimethoxyphenyl)methylidene]azanium chloride

Standard CAS: 51488-33-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
51488-33-6
Multi CAS
Yes
Molecular Formula
C9H13CLN2O2
Molecular Weight
216.660000
Exact Mass
216.066555
InChI
InChI=1S/C9H12N2O2.ClH/c1-12-7-4-3-6(9(10)11)5-8(7)13-2;/h3-5H,1-2H3,(H3,10,11);1H
InChIKey
JTKNCRAAATVMFV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
49.77
TPSA
70.07

LogP / Solubility

WLOGP
-3.83
MLOGP
-3.37
XLogP3
-3.83
Consensus LogP
-3.68
Log S (ESOL)
1.11
Class (ESOL)
Highly soluble
Log S (Ali)
1.43
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.75
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-6.76

Drug-likeness / Medicinal Chemistry

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

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