CAS RN: 1260591-49-8
Fmoc-4-trifluoromethyl-L-homophenylalanine
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.20250326 | 50mg / 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-031654
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
1260591-49-8 / (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[4-(trifluoromethyl)phenyl]butanoic acid
Basic Information
CAS
1260591-49-8
Multi CAS
No
Molecular Formula
C26H22F3NO4
Molecular Weight
469.500000
Exact Mass
469.150093
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCC4=CC=C(C=C4)C(F)(F)F)C(=O)O
InChI
InChI=1S/C26H22F3NO4/c27-26(28,29)17-12-9-16(10-13-17)11-14-23(24(31)32)30-25(33)34-15-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-10,12-13,22-23H,11,14-15H2,(H,30,33)(H,31,32)/t23-/m0/s1
InChIKey
WSAZRJANUJZPLG-QHCPKHFHSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Aromatic heavy atom count
18
Fraction Csp3
0.23
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
2
Molar refractivity
119.39
TPSA
75.63
LogP / Solubility
WLOGP
5.63
MLOGP
4.99
XLogP3
5.9
Consensus LogP
5.51
Log S (ESOL)
-6.23
Class (ESOL)
Insoluble
Log S (Ali)
-7.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.22
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.59
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
1,2-di-tert-butyl (2r)-4-oxopyrrolidine-1,2-dicarboxylate
- CAS RN: 1260591-66-9
- Product Code: SSC-031656
-
N-Fmoc-3-(trifluoromethoxy)-L-phenylalanine
- CAS RN: 1260592-32-2
- Product Code: SSC-031658
-
(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(pyridin-3-yl)butanoic acid
- CAS RN: 1260592-33-3
- Product Code: SSC-031659
-
N-FMoc-3-(2-biphenylyl)-L-alanine/(S)-2-(((9H-fluoren-9-yl)Methoxy)carbonylaMino)-3-(biphenyl-2-yl)propanoic acid
- CAS RN: 1260592-50-4
- Product Code: SSC-031660
-
1-tert-butyl 2-Methyl (2R)-azetidine-1,2-dicarboxylate
- CAS RN: 1260593-39-2
- Product Code: SSC-031661
-
(3R,4S)-4-(2-Chlorophenyl)pyrrolidine-3-carboxylic acid
- CAS RN: 1260593-59-6
- Product Code: SSC-031663
![CAS 1260592-33-3 (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(pyridin-3-yl)butanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1260592-33-3.gif)
