CAS RN: 2415263-07-7
Thalidomide-O-amido-C8-NH2 hydrochloride
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: starshine_CAS2415263-07-7
- Purity/Analytical Methods: >99.0%
2415263-07-7 / N-(8-aminooctyl)-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide;hydrochloride
Basic Information
CAS
2415263-07-7
Multi CAS
No
Molecular Formula
C23H31ClN4O6
Molecular Weight
495.000000
Exact Mass
494.193212
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCC(=O)NCCCCCCCCN.Cl
InChI
InChI=1S/C23H30N4O6.ClH/c24-12-5-3-1-2-4-6-13-25-19(29)14-33-17-9-7-8-15-20(17)23(32)27(22(15)31)16-10-11-18(28)26-21(16)30;/h7-9,16H,1-6,10-14,24H2,(H,25,29)(H,26,28,30);1H
InChIKey
KPPZEDZTBDIUJN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Aromatic heavy atom count
6
Fraction Csp3
0.52
Rotatable bonds
12
H-bond acceptors
7
H-bond donors
3
Molar refractivity
125.62
TPSA
147.9
LogP / Solubility
WLOGP
1.3
MLOGP
1.18
XLogP3
1.3
Consensus LogP
1.26
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.56
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.4
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.81
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
![CAS 2415337-01-6 Spiro[9H-fluorene-9,2′-tricyclo[3.3.1.13,7]decane], 4-bromo- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Spiro[9H-fluorene-9,2′-tricyclo[3.3.1.13,7]decane], 4-bromo-
- CAS RN: 2415337-01-6
- Product Code: starshine_CAS2415337-01-6
- Purity/Analytical method: >99.0%
-
(S)-tert-butyl 4-amino-3,3-difluoropiperidine-1-carboxylate
- CAS RN: 2415515-29-4
- Product Code: SSC-117943
-
INDEX NAME NOT YET ASSIGNED
- CAS RN: 2415751-83-4
- Product Code: starshine_CAS2415751-83-4
- Purity/Analytical method: >99.0%
-
1H-Benzimidazole, 2-ethyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]
- CAS RN: 2415827-15-3
- Product Code: SSC-117957
-
INDEX NAME NOT YET ASSIGNED
- CAS RN: 2415867-40-0
- Product Code: starshine_CAS2415867-40-0
- Purity/Analytical method: >99.0%
-
N-Fmoc-4-methyl-D-tryptophan
- CAS RN: 2415937-11-8
- Product Code: starshine_CAS2415937-11-8
- Purity/Analytical method: >99.0%
![CAS 2415337-01-6 Spiro[9H-fluorene-9,2′-tricyclo[3.3.1.13,7]decane], 4-bromo- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2415337-01-6.gif)
![CAS 2415827-15-3 1H-Benzimidazole, 2-ethyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2415827-15-3.gif)
