CAS RN: 2182602-22-6
Mal-amido-PEG9-amine TFA salt
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.20251023 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS2182602-22-6
- Purity/Analytical Methods: >99.0%
2182602-22-6 / N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
Basic Information
CAS
2182602-22-6
Multi CAS
No
Molecular Formula
C27H49N3O12
Molecular Weight
607.700000
Exact Mass
607.331624
SMILES
C1=CC(=O)N(C1=O)CCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN
InChI
InChI=1S/C27H49N3O12/c28-4-7-34-9-11-36-13-15-38-17-19-40-21-23-42-24-22-41-20-18-39-16-14-37-12-10-35-8-5-29-25(31)3-6-30-26(32)1-2-27(30)33/h1-2H,3-24,28H2,(H,29,31)
InChIKey
UNMUYHVKYAGOFQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
42
Fraction Csp3
0.81
Rotatable bonds
32
H-bond acceptors
13
H-bond donors
2
Molar refractivity
149.91
TPSA
175.57
LogP / Solubility
WLOGP
-1.47
MLOGP
-1.25
XLogP3
-2.5
Consensus LogP
-1.74
Log S (ESOL)
-0.57
Class (ESOL)
Very soluble
Log S (Ali)
-3.48
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-6.23
Class (SILICOS-IT)
Insoluble
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)
-7.47
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
-
![CAS 2182671-16-3 8H-Indeno[1,2-d]oxazole, 2,2′-[2-[4-(1,1-dimethylethyl)phenyl]-1-[[4-(1,1-dimethylethyl)phenyl]methyl]ethylidene]bis[3a,8a-dihydro-, (3aR,3’aR,8aS,8’aS)- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
8H-Indeno[1,2-d]oxazole, 2,2′-[2-[4-(1,1-dimethylethyl)phenyl]-1-[[4-(1,1-dimethylethyl)phenyl]methyl]ethylidene]bis[3a,8a-dihydro-, (3aR,3’aR,8aS,8’aS)-
- CAS RN: 2182671-16-3
- Product Code: SSC-105236
-
Varenicline-d4
- CAS RN: 2183239-01-0
- Product Code: starshine_CAS2183239-01-0
- Purity/Analytical method: >99.0%
-
(4E)-TCO-PEG4-biotin
- CAS RN: 2183440-30-2
- Product Code: starshine_CAS2183440-30-2
- Purity/Analytical method: >99.0%
-
-
APN-C3-PEG4-azide
- CAS RN: 2183440-32-4
- Product Code: starshine_CAS2183440-32-4
- Purity/Analytical method: >99.0%
-
Methyltetrazine-PEG8-NHS ester
- CAS RN: 2183440-34-6
- Product Code: starshine_CAS2183440-34-6
- Purity/Analytical method: >99.0%
![CAS 2182671-16-3 8H-Indeno[1,2-d]oxazole, 2,2′-[2-[4-(1,1-dimethylethyl)phenyl]-1-[[4-(1,1-dimethylethyl)phenyl]methyl]ethylidene]bis[3a,8a-dihydro-, (3aR,3’aR,8aS,8’aS)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2182671-16-3.png)
