CAS RN: 2458811-07-7
Bis-Mal-PEG6
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.20260602 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2458811-07-7
- Purity/Analytical Methods: >99.0%
2458811-07-7 / 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
Basic Information
CAS
2458811-07-7
Multi CAS
No
Molecular Formula
C28H42N4O12
Molecular Weight
626.700000
Exact Mass
626.279923
SMILES
C1=CC(=O)N(C1=O)CCC(=O)NCCOCCOCCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O
InChI
InChI=1S/C28H42N4O12/c33-23(5-9-31-25(35)1-2-26(31)36)29-7-11-39-13-15-41-17-19-43-21-22-44-20-18-42-16-14-40-12-8-30-24(34)6-10-32-27(37)3-4-28(32)38/h1-4H,5-22H2,(H,29,33)(H,30,34)
InChIKey
GPXKZMBVSUHQLW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
44
Fraction Csp3
0.64
Rotatable bonds
27
H-bond acceptors
12
H-bond donors
2
Molar refractivity
151.89
TPSA
188.34
LogP / Solubility
WLOGP
-2.05
MLOGP
-1.75
XLogP3
-3.7
Consensus LogP
-2.5
Log S (ESOL)
-0.65
Class (ESOL)
Very soluble
Log S (Ali)
-3.22
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.27
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-8
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
4
Customers Also Viewed
-
(S)-1-(4-Ethylphenyl)ethanamine hydrochloride
- CAS RN: 2459439-16-6
- Product Code: starshine_CAS2459439-16-6
- Purity/Analytical method: >99.0%
-
INDEX NAME NOT YET ASSIGNED
- CAS RN: 2459652-59-4
- Product Code: starshine_CAS2459652-59-4
- Purity/Analytical method: >99.0%
-
-
4-nitrobenzyl 2-(((tert-butyldimethylsilyl)oxy)methyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxylate
- CAS RN: 2460029-00-7
- Product Code: SSC-119422
-
-
Carbamic acid, N-[1-(1,1-dimethylethyl)-3-(3-oxocyclopentyl)-1H-pyrazol-5-yl]-, phenylmethyl ester
- CAS RN: 2460255-78-9
- Product Code: SSC-119429
![CAS 2460029-00-7 4-nitrobenzyl 2-(((tert-butyldimethylsilyl)oxy)methyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB65478954(1).gif)
![CAS 2460255-78-9 Carbamic acid, N-[1-(1,1-dimethylethyl)-3-(3-oxocyclopentyl)-1H-pyrazol-5-yl]-, phenylmethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2460255-78-9.gif)