![CAS 877049-90-6 6-TET phosphoramidite [5′-Tetrachlorofluorescein phosphoramidite] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/877049-90-6.gif)
CAS RN: 877049-90-6
6-TET phosphoramidite [5′-Tetrachlorofluorescein 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.20260108 | 25mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS877049-90-6
- Purity/Analytical Methods: >99.0%
877049-90-6 / [2',4,7,7'-tetrachloro-6-[6-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyhexylcarbamoyl]-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate
Basic Information
CAS
877049-90-6
Multi CAS
No
Molecular Formula
C46H54CL4N3O10P
Molecular Weight
981.700000
Exact Mass
981.227143
InChI
InChI=1S/C46H54Cl4N3O10P/c1-25(2)53(26(3)4)64(59-19-15-16-51)58-18-14-12-11-13-17-52-40(54)27-20-32(49)37-38(39(27)50)46(63-41(37)55)28-21-30(47)35(61-42(56)44(5,6)7)23-33(28)60-34-24-36(31(48)22-29(34)46)62-43(57)45(8,9)10/h20-26H,11-15,17-19H2,1-10H3,(H,52,54)
InChIKey
RKVIHIDUTMZQEZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
64
Aromatic heavy atom count
18
Fraction Csp3
0.5
Rotatable bonds
17
H-bond acceptors
12
H-bond donors
1
Molar refractivity
246.88
TPSA
162.72
LogP / Solubility
WLOGP
12.35
MLOGP
10.97
XLogP3
11
Consensus LogP
11.44
Log S (ESOL)
-12.8
Class (ESOL)
Insoluble
Log S (Ali)
-16.53
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.34
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)
0.06
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
6.5
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