CAS RN: 959395-07-4
(2S,2′S)-1,1′-Bis(2-pyridinylmethyl)-2,2′-bipyrrolidine tetrahydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250904 | 250mg | Out of stock | Inquiry |
- Product code: starshine_CAS959395-07-4
- Purity/Analytical Methods: >99.0%
959395-07-4 / 2-[[(2S)-2-[(2S)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]pyridine
Basic Information
CAS
959395-07-4
Multi CAS
Yes
Molecular Formula
C20H26N4
Molecular Weight
322.400000
Exact Mass
322.215747
InChI
InChI=1S/C20H26N4.4ClH/c1-3-11-21-17(7-1)15-23-13-5-9-19(23)20-10-6-14-24(20)16-18-8-2-4-12-22-18;;;;/h1-4,7-8,11-12,19-20H,5-6,9-10,13-16H2;4*1H
InChIKey
WTQUEUGYNCZETF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.5
Rotatable bonds
5
H-bond acceptors
4
Molar refractivity
95.34
TPSA
32.26
LogP / Solubility
WLOGP
3.11
MLOGP
2.75
XLogP3
2.3
Consensus LogP
2.72
Log S (ESOL)
-3.84
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.45
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.93
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4
Customers Also Viewed
-
![CAS 959395-10-9 (2S,2′S-()-[N,N′-Bis(2-pyridylmethyl)]-2,2′-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
(2S,2′S-()-[N,N′-Bis(2-pyridylmethyl)]-2,2′-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate
- CAS RN: 959395-10-9
- Product Code: SSC-211667
-
-
4-Hydroxyalternariol 9-methyl ether
- CAS RN: 959417-17-5
- Product Code: starshine_CAS959417-17-5
- Purity/Analytical method: >99.0%
-
4-Hydroxyalternariol
- CAS RN: 959417-21-1
- Product Code: starshine_CAS959417-21-1
- Purity/Analytical method: >99.0%
-
1,4-di-tert-butyl 2-methylpiperazine-1,4-dicarboxylate
- CAS RN: 959417-67-5
- Product Code: starshine_CAS959417-67-5
- Purity/Analytical method: >99.0%
-
Benzenamine, 2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-N-[2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]phenyl]-
- CAS RN: 959427-23-7
- Product Code: SSC-211669
![CAS 959395-10-9 (2S,2′S-()-[N,N′-Bis(2-pyridylmethyl)]-2,2′-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/959395-10-9.gif)
![CAS 959406-40-7 3-Bromomethyl-5-methyl[1,2,4]oxadiazole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/959406-40-7.gif)
![CAS 959427-23-7 Benzenamine, 2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-N-[2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]phenyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/959427-23-7.gif)