CAS RN: 2381-07-9
AC-TYR-NHNH2
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250120 | 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2381-07-9
- Purity/Analytical Methods: >99.0%
2381-07-9 / N-[(2S)-1-hydrazinyl-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]acetamide
Basic Information
CAS
2381-07-9
Multi CAS
No
Molecular Formula
C11H15N3O3
Molecular Weight
237.250000
Exact Mass
237.111341
SMILES
CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NN
InChI
InChI=1S/C11H15N3O3/c1-7(15)13-10(11(17)14-12)6-8-2-4-9(16)5-3-8/h2-5,10,16H,6,12H2,1H3,(H,13,15)(H,14,17)/t10-/m0/s1
InChIKey
CRZZRSWETKBGET-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
4
Molar refractivity
61.75
TPSA
104.45
LogP / Solubility
WLOGP
-0.57
MLOGP
-0.5
XLogP3
-1.1
Consensus LogP
-0.72
Log S (ESOL)
-0.95
Class (ESOL)
Very soluble
Log S (Ali)
-1.09
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.21
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)
-4.57
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
2
Customers Also Viewed
-
-
-
LITHIUM ISOPROPOXIDE
- CAS RN: 2388/10/5
- Product Code: starshine_CAS2388-10-5
- Purity/Analytical method: >99.0%
-
13-Oxotetradecanoic acid
- CAS RN: 2389-02-8
- Product Code: starshine_CAS2389-02-8
- Purity/Analytical method: >99.0%
-
-
