CAS RN: 2172256-78-7
Palbociclib Impurity I
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.20250613 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2172256-78-7
- Purity/Analytical Methods: >99.0%
2172256-78-7 / 6-acetyl-8-cyclopentyl-5-methyl-1H-pyrido[2,3-d]pyrimidine-2,7-dione
Basic Information
CAS
2172256-78-7
Multi CAS
No
Molecular Formula
C15H17N3O3
Molecular Weight
287.310000
Exact Mass
287.126991
SMILES
CC1=C(C(=O)N(C2=C1C=NC(=O)N2)C3CCCC3)C(=O)C
InChI
InChI=1S/C15H17N3O3/c1-8-11-7-16-15(21)17-13(11)18(10-5-3-4-6-10)14(20)12(8)9(2)19/h7,10H,3-6H2,1-2H3,(H,16,17,21)
InChIKey
LXLRGUPUCQJUCY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
10
Fraction Csp3
0.47
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
78.87
TPSA
84.82
LogP / Solubility
WLOGP
1.71
MLOGP
1.52
XLogP3
0.2
Consensus LogP
1.14
Log S (ESOL)
-2.92
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.15
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.19
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.26
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
(S)-1-(3-BROMOPHENYL)ETHANAMINE HYDROCHLORIDE
- CAS RN: 2172274-44-9
- Product Code: SSC-104703
-
3,4,5-Trihydroxyallylbenzene 3,4-di-O-glucoside
- CAS RN: 2172431-63-7
- Product Code: starshine_CAS2172431-63-7
- Purity/Analytical method: >99.0%
-
-
7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
- CAS RN: 2172466-50-9
- Product Code: SSC-104722
-
2-[(cyanomethyl)({[(9H-fluoren-9-yl)methoxy]carbonyl})amino]acetic acid
- CAS RN: 2172570-83-9
- Product Code: SSC-104743
-
![CAS 2172466-50-9 7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2172466-50-9.png)
![CAS 2172570-83-9 2-[(cyanomethyl)({[(9H-fluoren-9-yl)methoxy]carbonyl})amino]acetic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2172570-83-9.png)
