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CAS 67659-37-4 (S)-(-)-1,1-DIPHENYL-2-AMINOPROPANE molecular structure lightbox
CAS RN: 67659-37-4

(S)-(-)-1,1-DIPHENYL-2-AMINOPROPANE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250423 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS67659-37-4
  • Purity/Analytical Methods: >99.0%
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67659-37-4 / 1,1-diphenylpropan-2-amine

Standard CAS: 67659-37-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
67659-37-4
Multi CAS
Yes
Molecular Formula
C15H17N
Molecular Weight
211.300000
Exact Mass
211.136100
InChI
InChI=1S/C15H17N/c1-12(16)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,15H,16H2,1H3
InChIKey
XNKICCFGYSXSAI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.2
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
68.38
TPSA
26.02

LogP / Solubility

WLOGP
3.17
MLOGP
2.79
XLogP3
2.7
Consensus LogP
2.89
Log S (ESOL)
-3.5
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.58
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.02
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.76

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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