CAS RN: 500577-51-5
Cyclo (-RGDfK) 2,2,2-Trifluoroacetic acid
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250810 | 1mg / 10mg / 25mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250809 | 100mg | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20251016 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250307 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250127 | 1mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20250311 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250524 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250512 | 50mg | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20250624 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS500577-51-5
- Purity/Analytical Methods: >99.0%
500577-51-5 / 2-[(2S,5R,8S,11S)-8-(4-aminobutyl)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid;2,2,2-trifluoroacetic acid
Basic Information
CAS
500577-51-5
Multi CAS
Yes
Molecular Formula
C29F3H42N9O9
Molecular Weight
717.700000
Exact Mass
717.305758
InChI
InChI=1S/C27H41N9O7.C2HF3O2/c28-11-5-4-9-18-24(41)34-17(10-6-12-31-27(29)30)23(40)32-15-21(37)33-20(14-22(38)39)26(43)36-19(25(42)35-18)13-16-7-2-1-3-8-16;3-2(4,5)1(6)7/h1-3,7-8,17-20H,4-6,9-15,28H2,(H,32,40)(H,33,37)(H,34,41)(H,35,42)(H,36,43)(H,38,39)(H4,29,30,31);(H,6,7)/t17-,18-,19+,20-;/m0./s1
InChIKey
WHCQIPJAWCYHFT-HXSCNMCGSA-N
Computed Properties
Structural Parameters
Heavy atom count
50
Aromatic heavy atom count
6
Fraction Csp3
0.52
Rotatable bonds
12
H-bond acceptors
9
H-bond donors
10
Molar refractivity
169.64
TPSA
310.52
LogP / Solubility
WLOGP
-2.41
MLOGP
-2.06
XLogP3
-2.41
Consensus LogP
-2.29
Log S (ESOL)
-2.07
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.7
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.76
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-8.81
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
7.5
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- Product Code: SSC-156378
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- Product Code: starshine_CAS500588-73-8
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![CAS 500579-04-4 2,2′-[[Dihydro-2-(4-pyridinyl)-1,3(2H,4H)-pyrimidinediyl]bis(methylene)]bis[N,N-dimethylbenzenamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/500579-04-4.gif)
