![CAS 145300-45-4 N-[4-(1,3-THIAZOLAN-2-YL)PHENYL]ACETAMIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/145300-45-4.gif)
CAS RN: 145300-45-4
N-[4-(1,3-THIAZOLAN-2-YL)PHENYL]ACETAMIDE
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.20260430 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS145300-45-4
- Purity/Analytical Methods: >99.0%
145300-45-4 / N-[4-(1,3-thiazolidin-2-yl)phenyl]acetamide
Basic Information
CAS
145300-45-4
Multi CAS
No
Molecular Formula
C11H14N2OS
Molecular Weight
222.310000
Exact Mass
222.082684
SMILES
CC(=O)NC1=CC=C(C=C1)C2NCCS2
InChI
InChI=1S/C11H14N2OS/c1-8(14)13-10-4-2-9(3-5-10)11-12-6-7-15-11/h2-5,11-12H,6-7H2,1H3,(H,13,14)
InChIKey
UTUASLMFNMSSIQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
63.95
TPSA
41.13
LogP / Solubility
WLOGP
1.98
MLOGP
1.75
XLogP3
0.6
Consensus LogP
1.44
Log S (ESOL)
-2.63
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.81
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.99
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
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)
-2.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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