CAS RN: 1355238-98-0
(6-iodopyridin-3-yl)methanamine
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260304 | 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS1355238-98-0
- Purity/Analytical Methods: >99.0%
1355238-98-0 / (6-iodo-3-pyridinyl)methanamine
Basic Information
CAS
1355238-98-0
Multi CAS
No
Molecular Formula
C6H7IN2
Molecular Weight
234.040000
Exact Mass
233.965400
SMILES
C1=CC(=NC=C1CN)I
InChI
InChI=1S/C6H7IN2/c7-6-2-1-5(3-8)4-9-6/h1-2,4H,3,8H2
InChIKey
GJLUJVBIKCHHEH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.85
TPSA
38.91
LogP / Solubility
WLOGP
1.14
MLOGP
1.01
XLogP3
0.4
Consensus LogP
0.85
Log S (ESOL)
-2.44
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.31
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
Class (SILICOS-IT)
Moderately 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)
-3.33
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
(S)-2-(3-Fluorophenyl)pyrrolidine D-Tartrate
- CAS RN: 1355239-03-0
- Product Code: SSC-044049
-
-
4-BroMo-2-(4-BOC-piperazinoMethyl)-1-fluorobenzene
- CAS RN: 1355247-99-2
- Product Code: starshine_CAS1355247-99-2
- Purity/Analytical method: >99.0%
-
1-(4-ForMylphenyl)azetidine-3-carboxylic acid
- CAS RN: 1355248-05-3
- Product Code: SSC-044051
-
Ethyl 4-iodo-1-(4-methoxybenzyl)-1H-pyrazole-3-carboxylate
- CAS RN: 1355249-29-4
- Product Code: SSC-044052
-
O-(2,5,8,11-tetraoxatridecan-13-yl)hydroxylamine
- CAS RN: 1355318-41-0
- Product Code: starshine_CAS1355318-41-0
- Purity/Analytical method: >99.0%
![CAS 1355241-50-7 5-BroMo-2-chloro-thiazolo[5,4-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1355241-50-7.gif)
