CAS RN: 26582-86-5
Z-SER-NHNH2
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.20251009 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS26582-86-5
- Purity/Analytical Methods: >99.0%
26582-86-5 / benzyl N-(1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl)carbamate
Basic Information
CAS
26582-86-5
Multi CAS
No
Molecular Formula
C11H15N3O4
Molecular Weight
253.250000
Exact Mass
253.106256
SMILES
C1=CC=C(C=C1)COC(=O)NC(CO)C(=O)NN
InChI
InChI=1S/C11H15N3O4/c12-14-10(16)9(6-15)13-11(17)18-7-8-4-2-1-3-5-8/h1-5,9,15H,6-7,12H2,(H,13,17)(H,14,16)/t9-/m0/s1
InChIKey
WUDRJXCGIRLAEC-VIFPVBQESA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
4
Molar refractivity
62.97
TPSA
113.68
LogP / Solubility
WLOGP
-0.74
MLOGP
-0.64
XLogP3
-0.6
Consensus LogP
-0.66
Log S (ESOL)
-0.86
Class (ESOL)
Very soluble
Log S (Ali)
-1.11
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.29
Class (SILICOS-IT)
Soluble
ADME
GI absorption
Low
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)
-4.79
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
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