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CAS 1201582-92-4 1-Cyclopentyl-3-azetidinol molecular structure lightbox
CAS RN: 1201582-92-4

1-Cyclopentyl-3-azetidinol

  • Product code: SSC-020942
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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: ＞95%
  • 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 1201582-92-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shenzhen Inquiry

1201582-92-4 / 1-cyclopentylazetidin-3-ol

1-cyclopentylazetidin-3-ol | 1-cyclopentyl-3-azetidinol | MFCD18309090

Standard CAS: 1201582-92-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1201582-92-4
Multi CAS
No
Molecular Formula
C8H15NO
Molecular Weight
141.210000
Exact Mass
141.115364
SMILES
C1CCC(C1)N2CC(C2)O
InChI
InChI=1S/C8H15NO/c10-8-5-9(6-8)7-3-1-2-4-7/h7-8,10H,1-6H2
InChIKey
FNAYMOBMZYNSPJ-UHFFFAOYSA-N
Synonyms
1-cyclopentylazetidin-3-ol 1-cyclopentyl-3-azetidinol MFCD18309090 SCHEMBL2181382 FNAYMOBMZYNSPJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
39.84
TPSA
23.47

LogP / Solubility

WLOGP
0.61
MLOGP
0.53
XLogP3
0.7
Consensus LogP
0.61
Log S (ESOL)
-1.03
Class (ESOL)
Soluble
Log S (Ali)
-1.16
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.2
Class (SILICOS-IT)
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)
-3.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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