CAS RN: 287980-24-9
2′-Deoxy-5′-DMT-5-ethenyluridine 3′-CE phosphoramidite
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.20250116 | 25mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS287980-24-9
- Purity/Analytical Methods: >99.0%
287980-24-9 / 3-[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-ethenyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
Basic Information
CAS
287980-24-9
Multi CAS
No
Molecular Formula
C41H49N4O8P
Molecular Weight
756.800000
Exact Mass
756.328802
InChI
InChI=1S/C41H49N4O8P/c1-8-30-26-44(40(47)43-39(30)46)38-25-36(53-54(51-24-12-23-42)45(28(2)3)29(4)5)37(52-38)27-50-41(31-13-10-9-11-14-31,32-15-19-34(48-6)20-16-32)33-17-21-35(49-7)22-18-33/h8-11,13-22,26,28-29,36-38H,1,12,24-25,27H2,2-7H3,(H,43,46,47)/t36-,37+,38+,54?/m0/s1
InChIKey
DTIGDKGQABDJTJ-VPJZQFIISA-N
Computed Properties
Structural Parameters
Heavy atom count
54
Aromatic heavy atom count
24
Fraction Csp3
0.39
Rotatable bonds
18
H-bond acceptors
11
H-bond donors
1
Molar refractivity
208.29
TPSA
137.27
LogP / Solubility
WLOGP
7.15
MLOGP
6.36
XLogP3
6.1
Consensus LogP
6.54
Log S (ESOL)
-8.18
Class (ESOL)
Insoluble
Log S (Ali)
-10.93
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.68
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)
-2.26
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7
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