CAS RN: 634616-95-8
TBPB
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.20250628 | 5mg / 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS634616-95-8
- Purity/Analytical Methods: >99.0%
634616-95-8 / 3-[1-[1-[(2-methylphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one
Basic Information
CAS
634616-95-8
Multi CAS
Yes
Molecular Formula
C25H32N4O
Molecular Weight
404.500000
Exact Mass
404.257612
InChI
InChI=1S/C25H32N4O/c1-19-6-2-3-7-20(19)18-27-14-10-21(11-15-27)28-16-12-22(13-17-28)29-24-9-5-4-8-23(24)26-25(29)30/h2-9,21-22H,10-18H2,1H3,(H,26,30)
InChIKey
CWPKTBMRVATCBL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
15
Fraction Csp3
0.48
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
121.88
TPSA
44.27
LogP / Solubility
WLOGP
3.94
MLOGP
3.49
XLogP3
4.4
Consensus LogP
3.94
Log S (ESOL)
-4.94
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.72
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.04
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
-
-
N-[2-[4-(2-METHOXYPHENYL)-1-PIPERAZINYL]ETHYL]-N-2-PYRIDINYL-CYCLOHEXANECARBOXAMIDE MALEATE
- CAS RN: 634908-75-1
- Product Code: starshine_CAS634908-75-1
- Purity/Analytical method: >99.0%
-
2-Benzothiazolamine,6-chloro-5-fluoro-(9CI)
- CAS RN: 634909-27-6
- Product Code: starshine_CAS634909-27-6
- Purity/Analytical method: >99.0%
-
3-[[(tert-Butoxy)carbonyl]amino]-5-fluoro-4-oxopentanoic acid methyl ester
- CAS RN: 634911-80-1
- Product Code: starshine_CAS634911-80-1
- Purity/Analytical method: >99.0%
-
“AER-271(AER271)”
- CAS RN: 634913-39-6
- Product Code: starshine_CAS634913-39-6
- Purity/Analytical method: >99.0%
![CAS 634905-21-8 BORONIC ACID, B-[3-(1-PIPERIDINYL)PHENYL]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634905-21-8.gif)
![CAS 634908-75-1 N-[2-[4-(2-METHOXYPHENYL)-1-PIPERAZINYL]ETHYL]-N-2-PYRIDINYL-CYCLOHEXANECARBOXAMIDE MALEATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634908-75-1.gif)
![CAS 634911-80-1 3-[[(tert-Butoxy)carbonyl]amino]-5-fluoro-4-oxopentanoic acid methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634911-80-1.gif)
