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CAS 73709-20-3 N-(4-METHOXYPHENYL)GUANIDINEHYDROCHLORIDE molecular structure lightbox
CAS RN: 73709-20-3

N-(4-METHOXYPHENYL)GUANIDINEHYDROCHLORIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251203 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS73709-20-3
  • Purity/Analytical Methods: >99.0%
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73709-20-3 / 2-(4-methoxyphenyl)guanidine;hydrochloride

Standard CAS: 73709-20-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73709-20-3
Multi CAS
Yes
Molecular Formula
C8H12CLN3O
Molecular Weight
201.650000
Exact Mass
201.066890
InChI
InChI=1S/C8H11N3O.ClH/c1-12-7-4-2-6(3-5-7)11-8(9)10;/h2-5H,1H3,(H4,9,10,11);1H
InChIKey
DLEYULVIAMXWKA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
55.71
TPSA
73.63

LogP / Solubility

WLOGP
1.02
MLOGP
0.9
XLogP3
1.02
Consensus LogP
0.98
Log S (ESOL)
-1.94
Class (ESOL)
Soluble
Log S (Ali)
-1.95
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.06
Class (SILICOS-IT)
Moderately 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)
-3.22

Drug-likeness / Medicinal Chemistry

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

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