CAS RN: 832720-36-2
Elagolix Sodium
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250125 | 1ml | In stock | Inquiry |
- Product code: starshine_CAS832720-36-2
- Purity/Analytical Methods: >99.0%
832720-36-2 / sodium 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoate
Basic Information
CAS
832720-36-2
Multi CAS
Yes
Molecular Formula
C32H29F5N3NAO5
Molecular Weight
653.600000
Exact Mass
653.192506
InChI
InChI=1S/C32H30F5N3O5.Na/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33;/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42);/q;+1/p-1/t25-;/m0./s1
InChIKey
DQYGXRQUFSRDCH-UQIIZPHYSA-M
Computed Properties
Structural Parameters
Heavy atom count
46
Aromatic heavy atom count
24
Fraction Csp3
0.28
Rotatable bonds
12
H-bond acceptors
8
H-bond donors
1
Molar refractivity
153.58
TPSA
105.39
LogP / Solubility
WLOGP
1.2
MLOGP
1.11
XLogP3
1.2
Consensus LogP
1.17
Log S (ESOL)
-4.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.79
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.35
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
Customers Also Viewed
-
![CAS 832720-84-0 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-, ethyl ester molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-, ethyl ester
- CAS RN: 832720-84-0
- Product Code: SSC-191151
-
2-(1,3-Dihydroxypropan-2-yl)isoindoline-1,3-dione
- CAS RN: 832730-58-2
- Product Code: SSC-191152
-
3-bromo-10H-phenoxazine
- CAS RN: 832734-15-3
- Product Code: starshine_CAS832734-15-3
- Purity/Analytical method: >99.0%
-
-
2-BENZYLOXYPYRIDINE-5-BORONIC ACID, PINACOL ESTER
- CAS RN: 832735-54-3
- Product Code: SSC-191155
-
![CAS 832720-84-0 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-, ethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/832720-84-0.gif)
