![CAS 477559-83-4 “(11aS)-10,11,12,13-tetrahydro-N,N-bis(1-methylethyl)-Diindeno[7,1-de:1′,7′-fg][1,3,2]dioxaphosphocin-5-amine” molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/477559-83-4.gif)
CAS RN: 477559-83-4
“(11aS)-10,11,12,13-tetrahydro-N,N-bis(1-methylethyl)-Diindeno[7,1-de:1′,7′-fg][1,3,2]dioxaphosphocin-5-amine”
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260630 | 100mg | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260506 | 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20250403 | 1g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251113 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: starshine_CAS477559-83-4
- Purity/Analytical Methods: >99.0%
477559-83-4 / (5aS)-N,N-di(propan-2-yl)-10,30a-dihydroiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin-5-amine
Basic Information
CAS
477559-83-4
Multi CAS
Yes
Molecular Formula
C23H26NO2P
Molecular Weight
379.400000
Exact Mass
379.170116
InChI
InChI=1S/C23H26NO2P/c1-14(2)24(15(3)4)20-13-17-8-6-10-19-22(17)23(20)12-11-16-7-5-9-18(21(16)23)25-27-26-19/h5-8,10-15,18,27H,9H2,1-4H3/t18?,23-,27?/m0/s1
InChIKey
RJVLMCJJUBEMLS-MFBFOBPNSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
6
Fraction Csp3
0.39
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
111.95
TPSA
21.7
LogP / Solubility
WLOGP
5.51
MLOGP
4.87
XLogP3
4.7
Consensus LogP
5.03
Log S (ESOL)
-5.63
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.65
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.06
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.12
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6
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![CAS 477575-56-7 (2R)-1-[[5-[(Z)-[5-[[(2,6-DICHLOROPHENYL)METHYL]SULFONYL]-1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE]METHYL]-2,4-DIMETHYL-1H-PYRROL-3-YL]CARBONYL]-2-(1-PYRROLIDINYLMETHYL)PYRROLIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/477575-56-7.gif)
