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CAS 194940-93-7 1-(4-Morpholinophenyl)-1-phenylprop-2-yn-1-ol molecular structure lightbox
CAS RN: 194940-93-7

1-(4-Morpholinophenyl)-1-phenylprop-2-yn-1-ol

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260320 200mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-091929
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 194940-93-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry

194940-93-7 / 1-(4-morpholin-4-ylphenyl)-1-phenylprop-2-yn-1-ol

Standard CAS: 194940-93-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
194940-93-7
Multi CAS
No
Molecular Formula
C19H19NO2
Molecular Weight
293.400000
Exact Mass
293.141579
SMILES
C#CC(C1=CC=CC=C1)(C2=CC=C(C=C2)N3CCOCC3)O
InChI
InChI=1S/C19H19NO2/c1-2-19(21,16-6-4-3-5-7-16)17-8-10-18(11-9-17)20-12-14-22-15-13-20/h1,3-11,21H,12-15H2
InChIKey
QYFQIRGYFJJVNQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.26
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
87.75
TPSA
32.7

LogP / Solubility

WLOGP
2.39
MLOGP
2.12
XLogP3
2.6
Consensus LogP
2.37
Log S (ESOL)
-3.37
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.69
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.91
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3

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