![CAS 885951-49-5 N-[(3-METHOXYBENZYL)OXY]-1-HYDRAZINECARBOXAMIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB8739081.gif)
CAS RN: 885951-49-5
N-[(3-METHOXYBENZYL)OXY]-1-HYDRAZINECARBOXAMIDE
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.20250616 | 5g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS885951-49-5
- Purity/Analytical Methods: >99.0%
885951-49-5 / 1-amino-3-[(3-methoxyphenyl)methoxy]urea
Basic Information
CAS
885951-49-5
Multi CAS
No
Molecular Formula
C9H13N3O3
Molecular Weight
211.220000
Exact Mass
211.095691
InChI
InChI=1S/C9H13N3O3/c1-14-8-4-2-3-7(5-8)6-15-12-9(13)11-10/h2-5H,6,10H2,1H3,(H2,11,12,13)
InChIKey
YVYMSKZLKHDLED-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
3
Molar refractivity
53.64
TPSA
85.61
LogP / Solubility
WLOGP
0.3
MLOGP
0.27
XLogP3
0.1
Consensus LogP
0.22
Log S (ESOL)
-1.37
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.76
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.8
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
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