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CAS 321863-61-0 [(S)-Cyclopropyl(phenyl)methyl]amine molecular structure lightbox
CAS RN: 321863-61-0

[(S)-Cyclopropyl(phenyl)methyl]amine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260225 50mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS321863-61-0
  • Purity/Analytical Methods: >99.0%
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321863-61-0 / cyclopropyl(phenyl)methanamine

Standard CAS: 321863-61-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
321863-61-0
Multi CAS
Yes
Molecular Formula
C10H13N
Molecular Weight
147.220000
Exact Mass
147.104799
InChI
InChI=1S/C10H13N/c11-10(9-6-7-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7,11H2/t10-/m1/s1
InChIKey
UCRSQPUGEDLYSH-SNVBAGLBSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.09
TPSA
26.02

LogP / Solubility

WLOGP
2.1
MLOGP
1.84
XLogP3
1.6
Consensus LogP
1.85
Log S (ESOL)
-2.35
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.28
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.6
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)
-2.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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