Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g
- Available purity: ≥95%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
2429965-93-3 / 2-(3-methylazetidin-3-yl)pyridine
Basic Information
CAS
2429965-93-3
Multi CAS
No
Molecular Formula
C9H12N2
Molecular Weight
148.200000
Exact Mass
148.100048
SMILES
CC1(CNC1)C2=CC=CC=N2
InChI
InChI=1S/C9H12N2/c1-9(6-10-7-9)8-4-2-3-5-11-8/h2-5,10H,6-7H2,1H3
InChIKey
ZPZXWGPVYBQWBV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.44
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.46
TPSA
24.92
LogP / Solubility
WLOGP
0.94
MLOGP
0.82
XLogP3
0.8
Consensus LogP
0.85
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-1.46
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.53
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 2430019-26-2 Butanoic acid, 4-(dimethylamino)-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]methylamino]-4-oxo-, 2-propen-1-yl ester, (3S)- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Butanoic acid, 4-(dimethylamino)-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]methylamino]-4-oxo-, 2-propen-1-yl ester, (3S)-
- CAS RN: 2430019-26-2
- Product Code: SSC-118476
-
PYR12
- CAS RN: 2432878-13-0
- Product Code: starshine_CAS2432878-13-0
- Purity/Analytical method: >99.0%
-
2＇,3＇:5,6]benzo[1,2-c][1,2,5]thiadiazole
- CAS RN: 2433725-51-8
- Product Code: starshine_CAS2433725-51-8
- Purity/Analytical method: >99.0%
-
1,2,4-Triazolo[4,3-a]pyrazine, 5-bromo-8-chloro-
- CAS RN: 2433901-33-6
- Product Code: SSC-118572
-
Cyclohexanemethanol, 4-[4-amino-3-(difluoromethyl)-1H-pyrazol-1-yl]-, trans-
- CAS RN: 2434841-21-9
- Product Code: SSC-118608
-
2,7-Diazaspiro[3.5]nonane-2-carboxylic acid, 7-(2-propyn-1-yl)-, 1,1-dimethylethyl ester
- CAS RN: 2434850-33-4
- Product Code: SSC-118622
![CAS 2430019-26-2 Butanoic acid, 4-(dimethylamino)-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]methylamino]-4-oxo-, 2-propen-1-yl ester, (3S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2430019-26-2.gif)
![CAS 2433725-51-8 2＇,3＇:5,6]benzo[1,2-c][1,2,5]thiadiazole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2433725-51-8.gif)
![CAS 2433901-33-6 1,2,4-Triazolo[4,3-a]pyrazine, 5-bromo-8-chloro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2433901-33-6.gif)
![CAS 2434841-21-9 Cyclohexanemethanol, 4-[4-amino-3-(difluoromethyl)-1H-pyrazol-1-yl]-, trans- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2434841-21-9.gif)
![CAS 2434850-33-4 2,7-Diazaspiro[3.5]nonane-2-carboxylic acid, 7-(2-propyn-1-yl)-, 1,1-dimethylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2434850-33-4.gif)