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CAS 69816-37-1 Aminoacetamidine Dihydrobromide molecular structure lightbox
CAS RN: 69816-37-1

Aminoacetamidine Dihydrobromide

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260123 1g In stock Inquiry
Batchno.20251111 250mg In stock Inquiry
Batchno.20250120 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250612 1g In stock Shanghai, Chengdu Inquiry
Batchno.20260301 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250202 5g In stock Shanghai, Tianjin Inquiry
  • Product code: ICTA1361
  • Purity/Analytical Methods: >95.0%(T)
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69816-37-1 / 2-aminoethanimidamide;dihydrobromide

Standard CAS: 69816-37-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69816-37-1
Multi CAS
Yes
Molecular Formula
C2H9BR2N3
Molecular Weight
234.920000
Exact Mass
234.914270
InChI
InChI=1S/C2H7N3.2BrH/c3-1-2(4)5;;/h1,3H2,(H3,4,5);2*1H
InChIKey
SLCZNGZFOVAAED-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
3
Molar refractivity
41.61
TPSA
75.89

LogP / Solubility

WLOGP
0.04
MLOGP
0.04
XLogP3
0.04
Consensus LogP
0.04
Log S (ESOL)
-1.25
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.13

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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