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CAS 832-68-8 phenanthridin-6-amine molecular structure lightbox
CAS RN: 832-68-8

phenanthridin-6-amine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260501 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS832-68-8
  • Purity/Analytical Methods: >99.0%
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832-68-8 / phenanthridin-6-amine

Standard CAS: 832-68-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
832-68-8
Multi CAS
Yes
Molecular Formula
C13H10N2
Molecular Weight
194.230000
Exact Mass
194.084398
InChI
InChI=1S/C13H10N2/c14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13/h1-8H,(H2,14,15)
InChIKey
FVCXJXKLDUJOFA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
63.66
TPSA
38.91

LogP / Solubility

WLOGP
2.97
MLOGP
2.61
XLogP3
3.1
Consensus LogP
2.89
Log S (ESOL)
-3.61
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

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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