CAS RN: 6612-73-3
3′-O-ACETYL-2′-DEOXYADENOSINE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250927 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS6612-73-3
- Purity/Analytical Methods: >99.0%
6612-73-3 / [5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] acetate
Basic Information
CAS
6612-73-3
Multi CAS
Yes
Molecular Formula
C12H15N5O4
Molecular Weight
293.280000
Exact Mass
293.112404
InChI
InChI=1S/C12H15N5O4/c1-6(19)20-7-2-9(21-8(7)3-18)17-5-16-10-11(13)14-4-15-12(10)17/h4-5,7-9,18H,2-3H2,1H3,(H2,13,14,15)/t7-,8+,9+/m0/s1
InChIKey
ORNWXPWLGGXUNT-DJLDLDEBSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
9
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
9
H-bond donors
2
Molar refractivity
70.9
TPSA
125.38
LogP / Solubility
WLOGP
-0.38
MLOGP
-0.32
XLogP3
-0.4
Consensus LogP
-0.37
Log S (ESOL)
-1.54
Class (ESOL)
Soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.61
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)
-4.78
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4
Customers Also Viewed
-
6-O-α-D-Mannopyranosyl-D-Mannose
- CAS RN: 6614-35-3
- Product Code: starshine_CAS6614-35-3
- Purity/Analytical method: >99.0%
-
-
-
Deacetylxylopic acid
- CAS RN: 6619-95-0
- Product Code: starshine_CAS6619-95-0
- Purity/Analytical method: >99.0%
-
Proglumide
- CAS RN: 6620-60-6
- Product Code: starshine_CAS6620-60-6
- Purity/Analytical method: >99.0%
-
