CAS RN: 1017250-30-4
2-METHYL-1-(1,3-THIAZOL-2-YL)PROPAN-1-AMINE
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.20250228 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1017250-30-4
- Purity/Analytical Methods: >99.0%
1017250-30-4 / 2-methyl-1-(1,3-thiazol-2-yl)propan-1-amine
2-METHYL-1-(1,3-THIAZOL-2-YL)PROPAN-1-AMINE | MFCD09891403 | AKOS010593686
Basic Information
CAS
1017250-30-4
Multi CAS
No
Molecular Formula
C7H12N2S
Molecular Weight
156.250000
Exact Mass
156.072120
SMILES
CC(C)C(C1=NC=CS1)N
InChI
InChI=1S/C7H12N2S/c1-5(2)6(8)7-9-3-4-10-7/h3-6H,8H2,1-2H3
InChIKey
VTMMLMUSFHMBLX-UHFFFAOYSA-N
Synonyms
2-METHYL-1-(1,3-THIAZOL-2-YL)PROPAN-1-AMINE
MFCD09891403
AKOS010593686
2-methyl-1-thiazol-2-yl-propan-1-amine
N14682
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
43.88
TPSA
38.91
LogP / Solubility
WLOGP
1.8
MLOGP
1.58
XLogP3
1.2
Consensus LogP
1.53
Log S (ESOL)
-2.18
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.41
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)
-2.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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