CAS RN: 66824-86-0
(1Z)-N”-HYDROXY-2,2-DIPHENYLETHANIMIDAMIDE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260301 | 100mg / 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS66824-86-0
- Purity/Analytical Methods: >99.0%
66824-86-0 / N'-hydroxy-2,2-diphenylethanimidamide
Basic Information
CAS
66824-86-0
Multi CAS
Yes
Molecular Formula
C14H14N2O
Molecular Weight
226.270000
Exact Mass
226.110613
InChI
InChI=1S/C14H14N2O/c15-14(16-17)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13,17H,(H2,15,16)
InChIKey
KTMXYVWQDZLZAI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
68.14
TPSA
58.61
LogP / Solubility
WLOGP
2.56
MLOGP
2.26
XLogP3
2.7
Consensus LogP
2.51
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.27
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.62
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
methyl 3-(benzylamino)-3-oxopropanoate
- CAS RN: 66825-16-9
- Product Code: starshine_CAS66825-16-9
- Purity/Analytical method: >99.0%
-
-
1H-Pyrrole-3-carboxylicacid,5-cyano-,methylester(9CI)
- CAS RN: 66832-08-4
- Product Code: SSC-176480
-
-
-
N-Benzyloxycarbonyl-N’-(tert-Butoxycarbonyl)-L-lysine
- CAS RN: 66845-42-9
- Product Code: SSC-176486
