CAS RN: 1365255-42-0
Uridine, 4′-C-azido-, 2′,3′,5′-tribenzoate
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.20251108 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1365255-42-0
- Purity/Analytical Methods: >99.0%
1365255-42-0 / [(2R,3S,4R,5R)-2-azido-3,4-dibenzoyloxy-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl benzoate
Basic Information
CAS
1365255-42-0
Multi CAS
No
Molecular Formula
C30H23N5O9
Molecular Weight
597.500000
Exact Mass
597.149577
SMILES
C1=CC=C(C=C1)C(=O)OC[C@@]2([C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)N=[N+]=[N-]
InChI
InChI=1S/C30H23N5O9/c31-34-33-30(18-41-26(37)19-10-4-1-5-11-19)24(43-28(39)21-14-8-3-9-15-21)23(42-27(38)20-12-6-2-7-13-20)25(44-30)35-17-16-22(36)32-29(35)40/h1-17,23-25H,18H2,(H,32,36,40)/t23-,24+,25-,30-/m1/s1
InChIKey
LMCOBFDRFKDIJU-FJRSXGRASA-N
Computed Properties
Structural Parameters
Heavy atom count
44
Aromatic heavy atom count
24
Fraction Csp3
0.17
Rotatable bonds
9
H-bond acceptors
11
H-bond donors
1
Molar refractivity
151.34
TPSA
191.75
LogP / Solubility
WLOGP
3.38
MLOGP
3.02
XLogP3
4.6
Consensus LogP
3.67
Log S (ESOL)
-5.48
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.43
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.97
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7
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