CAS RN: 98834-08-3
MORPHOLIN-4-YL-PIPERAZIN-1-YL-METHANONE
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g
- Available purity: >95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 98834-08-3
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
2
In Stock
|
Shanghai |
Inquiry |
| 0.25g |
>95% |
2
In Stock
|
Hong Kong |
Inquiry |
| 1g |
>95% |
2
In Stock
|
Beijing |
Inquiry |
98834-08-3 / morpholin-4-yl(piperazin-1-yl)methanone
Standard CAS: 98834-08-3
Multi CAS: Yes
Basic Information
CAS
98834-08-3
Multi CAS
Yes
Molecular Formula
C9H17N3O2
Molecular Weight
199.250000
Exact Mass
199.132077
InChI
InChI=1S/C9H17N3O2/c13-9(11-3-1-10-2-4-11)12-5-7-14-8-6-12/h10H,1-8H2
InChIKey
QRFWUPFGDJAVNO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.89
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.23
TPSA
44.81
LogP / Solubility
WLOGP
-0.66
MLOGP
-0.58
XLogP3
-1.3
Consensus LogP
-0.85
Log S (ESOL)
-0.66
Class (ESOL)
Very soluble
Log S (Ali)
-0.72
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.41
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5