![CAS 930782-73-3 1-[1-(DIPHENYLMETHYL)AZETIDIN-3-YL]PIPERAZINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/930782-73-3.gif)
CAS RN: 930782-73-3
1-[1-(DIPHENYLMETHYL)AZETIDIN-3-YL]PIPERAZINE
- Product code: SSC-207086
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
930782-73-3 / 1-(1-benzhydrylazetidin-3-yl)piperazine
Basic Information
CAS
930782-73-3
Multi CAS
No
Molecular Formula
C20H25N3
Molecular Weight
307.400000
Exact Mass
307.204848
InChI
InChI=1S/C20H25N3/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)23-15-19(16-23)22-13-11-21-12-14-22/h1-10,19-21H,11-16H2
InChIKey
YJBYVWPJFFLDEA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
94.53
TPSA
18.51
LogP / Solubility
WLOGP
2.37
MLOGP
2.09
XLogP3
2.7
Consensus LogP
2.39
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.79
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.1
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.92
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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