CAS RN: 62129-02-6
4-AMINO-2-BENZOOXAZOL-2-YL-PHENOL
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.20250906 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS62129-02-6
- Purity/Analytical Methods: >99.0%
62129-02-6 / 4-amino-2-(1,3-benzoxazol-2-yl)phenol
Basic Information
CAS
62129-02-6
Multi CAS
No
Molecular Formula
C13H10N2O2
Molecular Weight
226.230000
Exact Mass
226.074228
InChI
InChI=1S/C13H10N2O2/c14-8-5-6-11(16)9(7-8)13-15-10-3-1-2-4-12(10)17-13/h1-7,16H,14H2
InChIKey
JVPMCQUVQZEYKJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
65.52
TPSA
72.28
LogP / Solubility
WLOGP
2.78
MLOGP
2.45
XLogP3
2.4
Consensus LogP
2.54
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.42
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.56
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)
-2.12
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
-
-
-
-
[(1S)-1β,4aβ,5,7aβ-Tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-1-yl]β-D-glucopyranoside
- CAS RN: 62133-72-6
- Product Code: starshine_CAS62133-72-6
- Purity/Analytical method: >99.0%
-
-
4-(4-ACETYLANILINO)-4-OXOBUTANOIC ACID
- CAS RN: 62134-55-8
- Product Code: starshine_CAS62134-55-8
- Purity/Analytical method: >99.0%
![CAS 62133-72-6 [(1S)-1β,4aβ,5,7aβ-Tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-1-yl]β-D-glucopyranoside molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/62133-72-6.gif)
