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CAS 24067-11-6 N-(2-CHLORO-PHENYL)-GUANIDINE HYDROCHLORIDE molecular structure lightbox
CAS RN: 24067-11-6

N-(2-CHLORO-PHENYL)-GUANIDINE HYDROCHLORIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260612 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS24067-11-6
  • Purity/Analytical Methods: >99.0%
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24067-11-6 / 2-(2-chlorophenyl)guanidine;hydrochloride

Standard CAS: 24067-11-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
24067-11-6
Multi CAS
No
Molecular Formula
C7H9Cl2N3
Molecular Weight
206.070000
Exact Mass
205.017353
SMILES
C1=CC=C(C(=C1)N=C(N)N)Cl.Cl
InChI
InChI=1S/C7H8ClN3.ClH/c8-5-3-1-2-4-6(5)11-7(9)10;/h1-4H,(H4,9,10,11);1H
InChIKey
IMUSEVRDOXRQIE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
2
Molar refractivity
54.17
TPSA
64.4

LogP / Solubility

WLOGP
1.67
MLOGP
1.47
XLogP3
1.67
Consensus LogP
1.6
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.45
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.5
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)
-2.79

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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