CAS RN: 936338-86-2

1-cyclohexylhydrazine dihydrochloride

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  • Product code: starshine_CAS936338-86-2
  • Purity/Analytical Methods: >99.0%
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936338-86-2 / cyclohexylhydrazine;dihydrochloride

Standard CAS: 936338-86-2 Multi CAS: Yes

Basic Information

CAS
936338-86-2
Multi CAS
Yes
Molecular Formula
C6H16CL2N2
Molecular Weight
187.110000
Exact Mass
186.069054
InChI
InChI=1S/C6H14N2.2ClH/c7-8-6-4-2-1-3-5-6;;/h6,8H,1-5,7H2;2*1H
InChIKey
OASMNUIVJWKRRP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.69
TPSA
38.05

LogP / Solubility

WLOGP
1.63
MLOGP
1.43
XLogP3
1.63
Consensus LogP
1.56
Log S (ESOL)
-1.96
Class (ESOL)
Soluble
Log S (Ali)
-2.27
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
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)
-2.71

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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